Selected Cell
Cell:
Value:
Sample_metadata
REF
log2
MEAN_FC
SD_FC
FC
FC_BatchCorrected
perturbations
TFs
Automated_SS_simulations_mean
SamplesStandardDeviation_5.2
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| # Sample minimal metadata, connects the data to parameters in the model | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Experiment | Type | Growth condition | Target | Model parameter | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| blank_control_7 | control | adherent, non-aerated, non-stirred | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| water_control_7 | control | adherent, non-aerated, non-stirred | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| WT_5 | control | adherent, non-aerated, non-stirred | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| WT_perturbation_7 | control | adherent, non-aerated, non-stirred | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| KO51_mutant_6 | mutant | adherent, non-aerated, non-stirred | glpd | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN025-OE_6 | mutant | adherent, non-aerated, non-stirred | tsr | FBA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN025-OE_7 | mutant | adherent, non-aerated, non-stirred | tsr | FBA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN051-KO_5 | mutant | adherent, non-aerated, non-stirred, | glpD | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN051-OE_7 | mutant | adherent, non-aerated, non-stirred | glpD | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN250-OE_5 | mutant | adherent, non-aerated, non-stirred | pgi | PGI | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN250-OE_7 | mutant | adherent, non-aerated, non-stirred | pgi | PGI | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN302-OE_6 | mutant | adherent, non-aerated, non-stirred | pfkA | PFK | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN302-OE_7 | mutant | adherent, non-aerated, non-stirred | pfkA | PFK | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN303-OE_5 | mutant | adherent, non-aerated, non-stirred | pyk | PYK | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN303-OE_6 | mutant | adherent, non-aerated, non-stirred | pyk | PYK | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN303-OE_7 | mutant | adherent, non-aerated, non-stirred | pyk | PYK | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN430-OE_6 | mutant | adherent, non-aerated, non-stirred | gap | GAP | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN606-OE_6 | mutant | adherent, non-aerated, non-stirred | eno | ENO | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN627-OE_7 | mutant | adherent, non-aerated, non-stirred | ptsI | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN674-KO, NoxE OE_5 | mutant | adherent, non-aerated, non-stirred | ldh, noxe | LDH, NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN674-KO_5 | mutant | adherent, non-aerated, non-stirred | ldh | LDH | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN674-KO_6 | mutant | adherent, non-aerated, non-stirred | ldh | LDH | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN674-OE_5 | mutant | adherent, non-aerated, non-stirred | ldh | LDH | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| MPN674-OE_7 | mutant | adherent, non-aerated, non-stirred | ldh | LDH | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Tn674_mutant_7 | mutant | adherent, non-aerated, non-stirred | ldh | LDH | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Tn051_Gly_perturbation_7 | mutant, perturbation | adherent, non-aerated, non-stirred, glycerol | glpD | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| AA_perturbation_6 | perturbation | adherent, non-aerated, non-stirred | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Fe_perturbation_6 | perturbation | adherent, non-aerated, non-stirred | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Glu_perturbation_6 | perturbation | adherent, non-aerated, non-stirred | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Glucose_starv_perturbation_7 | perturbation | adherent, no aeration, non stirred | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Gly_ctrl_perturbation_7 | perturbation | adherent, non-aerated, non-stirred | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Gly_perturbation_6 | perturbation | adherent, non-aerated, non-stirred, glycerol | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Ox_perturbation_6 | perturbation | adherent, aerated, non-stirred | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| WT_noGluc_perturbation_7 | perturbation | adherent, non-aerated, non-stirred | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 24h_timecourse_4 | time course | adherent, non-aerated, non-stirred | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 48h_timecourse_4 | time course | adherent, non-aerated, non-stirred | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 6h_timecourse_4 | time course | adherent, non-aerated, non-stirred | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| M129_timecourse_24h_3 | time course, perturbation | adherent, aerated | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| M129_timecourse_48h_3 | time course, perturbation | adherent, aerated | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| M129_timecourse_6h_3 | time course, perturbation | adherent, aerated | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| M129_timecourse_96h_3 | time course, perturbation | adherent, aerated | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| B170_timecourse_24h_3 | time course, perturbation, mutant | non-adherent (grown in suspension), aerated | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| B170_timecourse_48h_3 | time course, perturbation, mutant | non-adherent (grown in suspension), aerated | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| B170_timecourse_6h_3 | time course, perturbation, mutant | non-adherent (grown in suspension), aerated | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| B170_timecourse_96h_3 | time course, perturbation, mutant | non-adherent (grown in suspension), aerated | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
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| # Refference blocks, use for normalization | |||||||||||||||||||||||||
| REF block 3 | REF block 5 | REF2 block 5 | REF1 block 6 | REF2 block 6 | REF Tns block 6 | REF Carolina block 6 | REF block 7 | ||||||||||||||||||
| metabolite | -5.291235943508763 | -5.103544545960096 | -5.348987592535131 | -3.2069495798466177 | -3.594322047910481 | -3.645710131768568 | -3.3282251681104125 | -4.300203638804396 | -4.057887627644341 | -3.615651048393792 | -3.53244841586067 | -3.5521225661088924 | -3.8335064172153532 | -3.8363868556295424 | -3.852617832014743 | -3.743615407928837 | -3.480108812831077 | -3.6670653056178018 | -4.119245976528575 | -3.9778968985451604 | -3.920194761518429 | -3.234159678653024 | -3.2183638111862214 | -3.3427126793668016 | |
| Acetate [-H(+)] | -9.066506945022454 | -9.063428693753687 | -9.17163770925642 | -8.349710017246984 | -8.329841816061567 | -8.330288174021497 | -8.326886339467286 | -8.284732497638071 | -8.332642420197063 | -8.68912679015451 | -8.655919839104602 | -8.785305052143155 | -8.898783477299395 | -8.895688116068243 | -8.90346156571192 | -8.719010231558157 | -8.905889717256038 | -8.731661838997134 | -8.731581111681704 | -8.676015156829042 | -8.71721318087095 | -9.222788119397325 | -9.223909178565616 | -9.244739221619804 | |
| Glycine [-H(+)] | -6.116603381559488 | -5.758917653676001 | -6.10754212210489 | -7.685184624721507 | -7.704035517554246 | -7.706227632280057 | -7.744079224762243 | -7.637132032506486 | -7.868153280040117 | -5.809705806563983 | -5.77066200630865 | -5.824023031166432 | -5.901642213917592 | -5.860514057439298 | -5.9735044299099735 | -6.600360950540488 | -6.551802587751853 | -6.605393588385071 | -6.596600421665636 | -6.536412017768344 | -6.569063229969429 | -5.363904797332835 | -5.288384523017487 | -5.394982578095355 | |
| Pyruvate [-H(+)] | -5.007440302810665 | -4.964872878563891 | -4.968271442894082 | -6.799856990598979 | -7.053835893756885 | -7.113919260215679 | -6.831003900589069 | -7.691241395079432 | -7.644060246754821 | -4.8457082040266775 | -4.811797545434793 | -4.8259405005312495 | -4.886277123479434 | -4.923604986675252 | -4.910297427303869 | -4.872344739658175 | -4.876787393557015 | -4.834253321937052 | -4.844750664397337 | -4.79389613851329 | -4.805865675167744 | -4.821700153048027 | -4.813482083645225 | -4.857308616273357 | |
| L-Alanine [-H(+)] | -4.716075790107105 | -4.722064065012187 | -4.665355898871143 | -3.8828265920750886 | -4.137079946280105 | -4.209984243732187 | -3.969775064466516 | -4.575689485969937 | -4.521236470819646 | -3.354458123353729 | -3.3695854698596452 | -3.3578147140002956 | -3.5031488616577677 | -3.5188896433855197 | -3.4892942057188963 | -3.5529286970373195 | -3.492187139280071 | -3.516426506844551 | -3.353756721091032 | -3.334115451427159 | -3.334187033942264 | -3.31656175476042 | -3.2984159986532533 | -3.286784066177743 | |
| Glycerone [-H(+)] | -10.918442475848535 | -10.83588369297463 | -10.691724376234124 | 0 | 0 | 0 | 0 | 0 | 0 | -10.397121547806417 | -10.36715622114406 | -10.343030839793004 | -10.59924419660714 | -10.527949881933058 | -10.648235577131913 | -10.192981666888656 | -9.972938691119268 | -10.295692809646855 | -10.940269716530363 | -11.083443303850567 | -10.858191538265878 | -10.206102161578137 | -9.987043894768656 | -9.986631548460089 | |
| Glycerol [-H(+)] | 0 | 0 | 0 | -9.371414609159483 | -9.47286452020389 | -9.542436782827975 | -9.530731259842858 | -10.346032918882212 | -10.105926693407156 | -7.70617327997969 | -7.835871603834507 | -7.774315529465071 | -7.800385909349509 | -7.714196130024073 | -7.7229370296382465 | -7.428008901789554 | -7.141065354559479 | -7.325556150351392 | -7.617835961015859 | -7.635605935418932 | -7.56290311736592 | -3.6988472033259576 | -3.4058107072577455 | -3.7582282757226544 | |
| Glycine [+F(-)] | 1.566740715989424 | 1.9434548546216848 | 1.6061574958084899 | 0 | 0 | 0 | 0 | 0 | 0 | -2.7110365373094214 | -2.774021376062288 | -2.741343988253358 | -2.9192378311057383 | -2.876850220199561 | -2.869371311816473 | -3.011451583579917 | -2.987130200120186 | -2.9749245486479774 | -3.238201037508814 | -3.250596135699481 | -3.2519142983772023 | 0 | 0 | 0 | |
| Orthophosphate [-H(+)] | -6.764059809775379 | -6.894437892577145 | -6.749105469432491 | -8.287712292768243 | -8.464502086399493 | -8.44688086024874 | -8.32254332682507 | -8.48745970605513 | -8.559184357318314 | -6.554113023861959 | -6.4382371103737075 | -6.5196407876044145 | -6.518034831082832 | -6.5229475689492125 | -6.527901135278549 | -6.5630817622190705 | -6.688683156609019 | -6.6141227769323585 | -6.593055852631609 | -6.46193661938523 | -6.509342826712231 | -6.934382697899661 | -6.920798591499228 | -6.91999183985012 | |
| L-Serine [-H(+)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -10.697153868346605 | -10.6374564380377 | -10.67772797793678 | |
| Pyruvate [+F(-)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.895974622557919 | -8.053719976432633 | -8.040646794347253 | -7.86233133789281 | -7.739816896468014 | -7.771556986326652 | -7.457137197684698 | -7.158819041138219 | -7.408455348164447 | -7.827298810240289 | -7.916027937900834 | -7.829792306592601 | -4.825551559150381 | -4.523425859566687 | -4.576425165871657 | |
| L-Alanine [+F(-)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.38454407583409 | -8.438485279488663 | -8.444399107790382 | -8.563857762483917 | -8.48990852243009 | -8.51213403719786 | -8.441931457455809 | -8.279596403317367 | -8.215184081554462 | -8.679193025118945 | -8.643910476084002 | -8.61982229297385 | -6.2101220792341865 | -6.011569836071832 | -5.966173061596231 | |
| Glycerone [+F(-)] | -6.549247077712243 | -6.448931998525764 | -6.601999245064953 | -6.7137352001541615 | -6.52823774219762 | -6.5503006436968985 | -6.775986765463662 | -6.672782862057705 | -6.618278984164743 | -6.835967905085311 | -6.662447245095448 | -6.754576987368793 | -6.877157492334035 | -6.916697731731943 | -6.855064076977673 | -6.84549993130503 | -6.847056232749836 | -6.817547090092781 | -6.787592907976107 | -6.753252207999856 | -6.823379235180419 | -6.270989582958935 | -6.189646291479429 | -6.193920451065765 | |
| Uracil [-H(+)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.87228658127721 | -7.654153394549689 | -7.676680685919104 | |
| Glycerol [+F(-)] | -3.916440965825486 | -3.8950312552738455 | -3.87076012277872 | -3.8262502314598423 | -3.843533353471932 | -4.005880820883005 | -3.9845850819733286 | -4.381249309398811 | -4.240809120470911 | -4.267456695725022 | -4.243719106182429 | -4.19461318678551 | -4.187783404055701 | -4.166149187780748 | -4.187758564205858 | -4.629102423553187 | -4.642989844271071 | -4.6233907803066 | -4.099179888515294 | -4.062715550139586 | -3.9941723724164806 | -4.083622395434879 | -4.036914759089383 | -4.1177598557320385 | |
| L-Proline [-H(+)] | -3.6072589180688146 | -3.5810307719439756 | -3.5759971944691333 | -3.18319526985041 | -3.1547743930622616 | -3.1387720618994908 | -3.204716370040528 | -3.218476630605703 | -3.166195490622551 | -3.5450617726058358 | -3.533360944365493 | -3.540544809201951 | -3.5697075815085606 | -3.5718681452153596 | -3.580711512390204 | -3.5849436411030062 | -3.560639914292117 | -3.558998216555066 | -3.562981619987421 | -3.4968275141298246 | -3.5440903874826883 | -3.0768754146296855 | -3.079399715891173 | -3.0817964847812207 | |
| L-Valine [-H(+)] | 0 | 0 | 0 | -7.4247456960260765 | -7.6757136739725915 | -7.545105729191573 | -7.375905535147194 | -7.675282710968546 | -7.532486092679752 | -6.8960435379809635 | -6.873965638154754 | -6.922533512591453 | -7.009126870068703 | -7.189567906450708 | -7.105127696611598 | -7.128807891510769 | -7.126606518051008 | -7.049523821675997 | -7.667243249879096 | -7.461654052745722 | -7.486682728802943 | -7.697020744882674 | -7.667719306980068 | -7.838897663450634 | |
| Orthophosphate [+F(-)] | -6.463334509093501 | -6.585347400349434 | -6.502673153616127 | -5.562913637790649 | -5.59151068205668 | -5.603253368303023 | -5.57938592485581 | -5.623686059689906 | -5.673887308425396 | -6.3090875661949415 | -6.286522880112139 | -6.334517333585605 | -6.253408851847619 | -6.227203525666767 | -6.223952136566936 | -6.299277622185656 | -6.276274036076918 | -6.292451124508396 | -6.246584088794792 | -6.227523912430366 | -6.2083936366735815 | -6.332173570080555 | -6.3266774997942 | -6.3337187999200575 | |
| L-Threonine [-H(+)] | -12.078004456286752 | -12.316078830920514 | -12.353267263108055 | 0 | 0 | 0 | 0 | 0 | 0 | -11.508998275791246 | -11.036182977143003 | -11.308547865698554 | -11.381769676559458 | -11.416528820252347 | -11.676492633779645 | -11.54871504098632 | -11.405845656632616 | -11.261815104290562 | -11.550907603487229 | -11.401386621801812 | -11.580773963776643 | 0 | 0 | 0 | |
| L-Cysteine [-H(+)] | -7.1045955925942845 | -6.863438609179948 | -7.0788789080621495 | -5.500161614850947 | -5.72416732615132 | -5.887371777427834 | -5.692553812006393 | -6.20210154311599 | -6.155048798437491 | -8.268913788376683 | -8.28769858615907 | -8.221837434382973 | -8.273807826699525 | -8.159520922523889 | -8.248551520088785 | -8.055872137166212 | -7.930519345045013 | -8.069955032123184 | -8.460261675284983 | -8.441966716918802 | -8.300458738170237 | -5.104353895432754 | -4.847554522537211 | -5.117175793870555 | |
| Nicotinate [-H(+)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.062565743139523 | -8.277650138547685 | -8.215051216335034 | -8.114116204586537 | -7.969600330008416 | -8.115053094102688 | -7.676401091721967 | -7.49626126155858 | -7.677180331682484 | -7.929054388115901 | -7.824405478541088 | -7.734014003929323 | -3.4608846457919507 | -3.1266172013684135 | -3.406049134313295 | |
| L-Serine [+F(-)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.371780362591485 | -7.340402292160142 | -7.337576169115843 | -7.385333749678891 | -7.364768468969668 | -7.407623264365167 | -7.393676516963508 | -7.4753297598421025 | -7.456194049468696 | -7.64260196329446 | -7.5860857748694315 | -7.6056384979851845 | 0 | 0 | 0 | |
| Thymine [-H(+)] | -1.200066579040036 | -1.1817442399816098 | -1.2034098149413808 | -1.2511327086721598 | -1.1884438389166878 | -1.190868360324418 | -1.2202150729951888 | -1.1850347861993353 | -1.1698390163559056 | -1.0909529445267094 | -1.1281654368676417 | -1.1045254349839884 | -1.0910460716497004 | -1.086276029158945 | -1.0873836938146326 | -1.056072749751162 | -1.0224155500749386 | -1.026213437414809 | -1.054648433709526 | -1.0837327801404464 | -1.0602590348283483 | -1.0924347268340113 | -1.0819606283109067 | -1.084658431234237 | |
| L-Leucine [-H(+)] | -6.761241323483517 | -6.870501779766852 | -6.898312898078091 | -5.6061260627230665 | -5.5036871139110985 | -5.482646942081388 | -5.603181619614528 | -5.507941851025786 | -5.5031709227055154 | -6.408802075816709 | -6.38792729773735 | -6.39520983840451 | -6.329310536615919 | -6.370407076339875 | -6.299517622814529 | -6.367520258354224 | -6.385081665645955 | -6.330621068759607 | -6.648413978861544 | -6.602802400742231 | -6.628735448787548 | -6.592722574745235 | -6.566705633648321 | -6.524759722681446 | |
| L-Asparagine [-H(+)] | -3.1422886834547468 | -3.1833101441548095 | -3.1499317116217513 | -3.2828380606569985 | -3.2138598563625944 | -3.2153361493097528 | -3.1694663661505516 | -2.9066604140766286 | -3.0879500335773136 | -3.949242927839983 | -3.9724835857120393 | -3.966141907372907 | -4.146435378324958 | -4.150947725190408 | -4.165225771422941 | -4.301310701450639 | -4.247418760565031 | -4.256072061815508 | -4.441662981485146 | -4.397122988543868 | -4.397504304803287 | -2.7582530803627603 | -2.7409616491542805 | -2.620347569839132 | |
| L-Ornithine [-H(+)] | -4.564778918092855 | -4.619422749629426 | -4.463174608942806 | -3.8076865046649955 | -4.237140334754452 | -4.035137249374263 | -4.100114615745735 | -4.441702175494282 | -4.3486277555129185 | -4.624781865303855 | -4.543676907956504 | -4.5337404797142575 | -4.540917809244486 | -4.511805212133987 | -4.550975626688615 | -4.844098492719327 | -4.964384528698062 | -4.9372478719435495 | -4.7260094094937495 | -4.6771534798771714 | -4.675713761141743 | -5.380900604328467 | -5.399364736536458 | -5.408032609173165 | |
| L-Aspartate [-H(+)] | -8.942247849806622 | -9.070013444443113 | -8.895353609964527 | -7.122261821005452 | -7.136385990157766 | -7.287449241602783 | -7.206290857964332 | -7.515407811618494 | -7.446747920816508 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| L-Homocysteine [-H(+)] | -3.455782388086403 | -3.4401971206167024 | -3.4667419152501706 | -3.947191938090315 | -3.939164303848439 | -3.997992818483996 | -3.978368468734372 | -4.0023311372490005 | -4.007418631771698 | -5.588755217752176 | -5.5984597342832005 | -5.550762171712503 | -3.9957960095934926 | -4.004401119256717 | -3.9344105091845876 | -4.0163396156688 | -4.015746270310439 | -4.081010001721866 | -5.714192270855701 | -5.748849238200808 | -5.737179553146756 | -4.041814624807788 | -4.091581774628835 | -4.064575145953302 | |
| Adenine [-H(+)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.035823096395582 | -8.033178645624178 | -8.135907986586322 | -7.765592939528463 | -7.746741592701591 | -7.71823939755328 | -7.783013679281762 | -7.690185239823621 | -7.785945561935179 | -8.303629500665437 | -8.345203722415995 | -8.308163860260253 | 0 | 0 | 0 | |
| L-Proline [+F(-)] | 0 | 0 | 0 | -8.937222233494492 | -8.368063808001114 | -8.37206037416185 | -8.868869833749258 | -8.296412610237322 | -8.414729053736364 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.317178523344404 | -8.156000887608984 | -8.185932131105208 | |
| L-Valine [+F(-)] | 0 | 0 | 0 | -6.684028277877506 | -6.20491664839861 | -6.129499394848438 | -6.517930348560249 | -6.260616283315738 | -6.25874196578452 | -8.749380607061825 | -8.793359573529694 | -8.820276996419718 | -8.770565391390667 | -8.742743982882425 | -8.766144099531473 | -8.635078641714125 | -8.567562026889043 | -8.568596883596427 | -8.946904844885658 | -8.891984001447604 | -8.94729655930961 | -5.768302007954923 | -5.607410766567995 | -5.630552362240859 | |
| L-Threonine [+F(-)] | -8.813763702935939 | -8.736808139494947 | -8.779559117715188 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| Acetyl phosphate [-H(+)] | 0 | 0 | 0 | -9.199589027392669 | -9.226434390444215 | -9.492970149261522 | -9.275880485289623 | -9.539557241768668 | -9.600406826788618 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.049653463817563 | -9.232463200601957 | -9.337198219966643 | |
| Carbamoyl phosphate [-H(+)] | 0 | 0 | 0 | -6.988630342864774 | -6.713565815704789 | -6.720029480402473 | -6.918992127778356 | -6.755420725785168 | -6.756198945513431 | -8.912604543382198 | -8.868920633408369 | -8.898969969303012 | -8.779074459398984 | -8.824819591291124 | -8.79129418096076 | -8.776341701419359 | -8.729262258939174 | -8.770575483832472 | -9.081659058643217 | -9.104659654245385 | -9.02328971880115 | -6.743416768491052 | -6.608836905045973 | -6.592016732664922 | |
| Thymine [+F(-)] | -5.186234916180486 | -5.266185186104787 | -5.145670341164413 | -4.3515552698301185 | -4.099861695970622 | -4.103085874917335 | -4.0766252065458435 | -3.799517704245167 | -3.856805982571884 | -4.564884482248691 | -4.375128897482808 | -4.481429827964744 | -4.59641162314367 | -4.6017077919189 | -4.611174282235595 | -4.713463759609848 | -4.778624720194191 | -4.650865594172728 | -4.583074261493751 | -4.606102870740621 | -4.555318426395733 | -5.036473787842616 | -4.9696702138555455 | -4.908231781056072 | |
| L-Glutamine [-H(+)] | -2.186222568486645 | -2.334190222157626 | -2.2442858902408895 | -1.8242090642750046 | -1.7420013412191542 | -1.777645238644889 | -1.6567072344756832 | -1.2369496303823029 | -1.5193280433078533 | -3.140821383017252 | -3.1777294508845504 | -3.186330584454807 | -3.2477795409701185 | -3.245207089748961 | -3.217624065646441 | -3.3235687461602517 | -3.350147698381409 | -3.3352162379339214 | -3.3239045093665958 | -3.2839249951159735 | -3.3051312679681573 | -1.7455442884343493 | -1.73114308263256 | -1.6551040299205706 | |
| L-Lysine [-H(+)] | -3.0086598117918255 | -3.0721683915018083 | -2.98922372990101 | -2.7289302772706288 | -3.097745558374066 | -2.936241239877283 | -2.9807471083955144 | -3.2065205946043327 | -3.096070638272342 | -3.1798287888937073 | -3.169399437071931 | -3.1062370129887835 | -3.1268105575268335 | -3.0494285574719537 | -3.1244089713652867 | -3.3886719245909216 | -3.428778137971608 | -3.4565824518971273 | -3.166450851033435 | -3.1704417579307522 | -3.179477484852203 | -4.008434861023264 | -4.017406236627535 | -3.9578242500231315 | |
| L-Glutamate [-H(+)] | -6.167630503952175 | -6.184280870529488 | -6.147053425458051 | -5.311412762939971 | -5.354434131689889 | -5.387432392415841 | -5.351520614191581 | -5.461070186465723 | -5.430923328536096 | -5.896948976863953 | -5.860096289036713 | -5.859989439499232 | -6.026172418844086 | -6.074952162638574 | -6.046616466120625 | -6.091441537212939 | -6.048414720796877 | -6.072845526902638 | -5.919721858247637 | -5.888552031790355 | -5.865513936803981 | -5.558974757098884 | -5.477423995200064 | -5.5734410432198365 | |
| L-Methionine [-H(+)] | -7.143079651415542 | -7.1944667417695545 | -7.119760473796367 | -5.03367711207922 | -5.487036377126577 | -5.566504392067741 | -5.296994107657653 | -6.372880850357659 | -6.244114620189253 | -6.987050621295636 | -7.013876740267805 | -6.942472048391325 | -6.684312309465418 | -6.60070255952067 | -6.6417810648576445 | -6.540516922804597 | -6.441874254438884 | -6.6328010594007205 | -7.271428136778917 | -7.229936014924384 | -7.211185299101427 | -4.365380451689969 | -4.148947178815789 | -4.660531354825392 | |
| D-Ribose [-H(+)] | -8.241619919888436 | -8.239401819201907 | -8.324858226322881 | -7.624261040782376 | -7.662714314671965 | -7.741787460600399 | -7.74582206382158 | -7.769803471331418 | -7.837298474809877 | -9.028902873226176 | -9.144343922967003 | -9.141411973551884 | -8.873000369169034 | -8.843295991731921 | -8.789875679532535 | -8.883688212288519 | -8.809451487345964 | -8.734323697039677 | -9.04326207564062 | -9.00145891157128 | -9.023754864164088 | -8.539447423469648 | -8.573833078456824 | -8.626919940807289 | |
| Guanine [-H(+)] | 0 | 0 | 0 | -6.210070900054706 | -5.703358654337146 | -5.631232282087406 | -6.106342807003122 | -5.689488007913214 | -5.704782207514659 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -5.993137762093058 | -5.832504841854661 | -5.874543301916291 | |
| L-Asparagine [+F(-)] | 0 | 0 | 0 | -4.752680741965348 | -4.326872173599681 | -4.128329162605857 | -4.503205138965058 | -4.002852042851992 | -4.040321041556858 | -6.108266356033804 | -6.206459091222912 | -6.06025332706411 | -6.273362638133396 | -6.175015880704715 | -6.094397530166776 | -6.118659716963203 | -6.283492550953943 | -6.281310462124013 | -6.619597270889567 | -6.65021922502161 | -6.583118744966131 | -4.640962836774615 | -4.610185266761996 | -4.5883245280141365 | |
| L-Ornithine [+F(-)] | 0 | 0 | 0 | -6.889613158429363 | -6.8824890362213935 | -6.9301516477620035 | -6.958676471423775 | -7.150799499515015 | -7.189444973860999 | -7.829022549487986 | -7.795125138152192 | -7.798417644127974 | -7.736613335600265 | -7.765973664257741 | -7.715500139356477 | -7.653341625408872 | -7.776646397535986 | -7.714568108240622 | -8.071245659044592 | -7.964154097303159 | -8.039562558180476 | -6.098113820992492 | -5.970794118863199 | -6.172980572339666 | |
| L-Aspartate [+F(-)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.962126265839132 | -9.904412580720155 | -10.060006206554444 | |
| L-Homocysteine [+F(-)] | 0 | 0 | 0 | -5.452497808418785 | -5.4270573228948225 | -5.332446610829687 | -5.404255920137622 | -5.477561766394171 | -5.447677998807569 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -5.437196462326506 | -5.21983332341352 | -5.557940579655181 | |
| Adenine [+F(-)] | -4.233855356049882 | -4.423730610971828 | -4.265771826799762 | -3.4014286167917014 | -3.3922597643073336 | -3.3316191567341655 | -3.1340971403676123 | -3.169664680946889 | -3.2379996323182936 | -4.497687662439935 | -4.435015142784058 | -4.42418305841149 | -4.557216722036279 | -4.529487968556335 | -4.536341715618544 | -4.6948842011987075 | -4.645051602502729 | -4.703800290099375 | -4.549538893077871 | -4.55833811196907 | -4.493675473118513 | -4.566992605227961 | -4.593571992860691 | -4.578761182605896 | |
| L-Histidine [-H(+)] | 0 | 0 | 0 | -6.410410434221653 | -8.005821287810912 | -8.287187094091447 | -6.42844472714639 | -8.027738120263056 | -8.317565771184098 | -8.475365013142117 | -8.599429697228983 | -8.42688837653582 | -8.97073147471453 | -8.822188529356772 | -8.843314076477421 | -8.784433829599879 | -8.729113952949227 | -8.771301861018953 | -9.469873974532188 | -9.27251345300116 | -9.42386211261161 | -8.647419214846517 | -8.556468800940939 | -8.791158445825985 | |
| Carbamoyl phosphate [+F(-)] | -1.9829755298811724 | -2.035015509346674 | -2.032654509494734 | -2.010852724155735 | -2.031396614956677 | -2.1022726913331296 | -1.950197767336993 | -1.9319572077209033 | -1.986194657758865 | -2.057563100990322 | -2.059269471750096 | -2.0595655822016443 | -2.0357922915259126 | -2.053134618350088 | -2.0448639801964665 | -2.10180249795164 | -2.105544269233863 | -2.091289728227041 | -2.150259919520091 | -2.1288336493951707 | -2.155730826508398 | -2.304101053944226 | -2.3447380837112823 | -2.3289075742071765 | |
| L-Phenylalanine [-H(+)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -5.581335284215385 | -5.523132746737963 | -5.670319636005603 | |
| L-Glutamine [+F(-)] | 0 | 0 | 0 | -4.845719238761684 | -4.330079959953254 | -4.1539685771638055 | -4.546135953149784 | -3.91193028709605 | -4.013074808056987 | -6.032737503818437 | -6.002739903417332 | -5.908165505866544 | -6.077534176249033 | -6.047297652786306 | -5.939010125555052 | -6.055033917092361 | -6.069670602965591 | -6.024730038636199 | -6.432516001966205 | -6.355699518977067 | -6.4150735111650805 | -4.480295462778462 | -4.456644340884028 | -4.362341440038154 | |
| L-Lysine [+F(-)] | -6.8269229261561435 | -6.719036594650444 | -6.7766321250090344 | -6.004769639783003 | -5.958725464332677 | -6.085807105710961 | -5.94987324125014 | -6.165609070426061 | -6.144251102985938 | -9.092667693314734 | -9.028732774322435 | -9.09963860718545 | -9.054036505840852 | -9.026563426254517 | -8.964034634823046 | -9.046677077056735 | -8.726486742692828 | -8.857454477071407 | -9.314955287073076 | -9.167544449903628 | -9.194681093261037 | -5.5945286344740826 | -5.522808475319653 | -5.7674646940999645 | |
| Pyridoxal [-H(+)] | 0 | 0 | 0 | -8.422204756710077 | -8.072763089973929 | -8.065304335321343 | -8.392312996814397 | -8.095201326698408 | -8.119218660308015 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| L-Methionine [+F(-)] | -9.40132766027276 | -9.170974103201857 | -9.24079684263332 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| Glycerone phosphate [-H(+)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.202576576224459 | -7.952787019357634 | -7.927431084732348 | |
| D-Ribose [+F(-)] | 0 | 0 | 0 | -6.757700684687668 | -6.810004764023791 | -6.836235700766727 | -6.831553587432978 | -7.004068511308587 | -6.882204557435488 | -7.7006025422103175 | -7.959126890071067 | -7.8651253854981 | -7.8761518166720625 | -7.936266639428855 | -7.939038364803493 | -7.480290929573414 | -7.4633938172568595 | -7.394834618152849 | -7.703031190069758 | -7.653425152791639 | -7.575462942818701 | -7.320162008095744 | -7.236695798956877 | -7.283879614267097 | |
| Guanine [+F(-)] | -7.196907511520528 | -7.06779596731162 | -6.983149650400195 | -6.281553245138427 | -6.560262979546428 | -6.696076670092553 | -6.493932068480989 | -6.6037758232005475 | -6.696790561728133 | -6.339223380740851 | -6.235372827540516 | -6.312508085110537 | -6.9980789387300595 | -6.979810189358509 | -7.070489632205309 | -6.770861856299826 | -6.922318740784627 | -6.876329841172347 | -6.935546348355002 | -6.908168966333749 | -7.086151644769739 | -7.262003133863182 | -7.321514062590227 | -7.288619498845516 | |
| sn-Glycerol 3-phosphate [-H(+)] | -1.600257857797665 | -1.6960147403065422 | -1.6176233622692715 | -1.352439863756953 | -1.272324693764534 | -1.3048049691523775 | -1.2330834263603325 | -0.9892932094462301 | -1.1670897917665086 | -2.879591995819058 | -2.8977555871179645 | -2.9187077840040114 | -3.1119138007164686 | -3.0866161244543378 | -3.094687245673508 | -3.219120369967058 | -3.1716939810167912 | -3.1893052203465735 | -3.3345287086797724 | -3.258102975419909 | -3.2912655889450457 | -1.584193843580048 | -1.5481285551436117 | -1.4539916154845818 | |
| L-Arginine [-H(+)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.7145706043808016 | -7.587504270145127 | -7.516410859103333 | |
| L-Histidine [+F(-)] | -9.791695936347452 | -9.612492519405833 | -9.789236054221558 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.794308238147332 | -7.705620765164084 | -7.687161153026266 | |
| L-Citrulline [-H(+)] | 0 | 0 | 0 | -7.673607788851695 | -7.775514646534548 | -7.757784932555019 | -7.8379752447433635 | -7.962224136325673 | -7.8822337511269485 | -8.444802374306931 | -8.538399438467803 | -8.586318322403546 | -9.033535644276746 | -8.98050987030888 | -9.05572868524349 | -9.038567161109075 | -8.888951892013992 | -9.100841203609106 | -9.752648566595184 | -9.723737785970645 | -9.766162542116838 | -8.479533999317963 | -8.538241719781466 | -8.470082396496784 | |
| Ascorbate [-H(+)] | -0.3493279232965336 | -0.11988311847034361 | -0.423939032130877 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| Diphosphate [-H(+)] | -4.09023510096274 | -4.149117354603382 | -4.103039430280049 | -2.1964884136956058 | -2.404705657147871 | -2.3707484990903587 | -2.2689657192051538 | -2.4911446146246674 | -2.4656093267783 | -2.8133085418313755 | -2.727676433039923 | -2.697397108338638 | -2.9843450715876507 | -2.9287355048246493 | -2.9621814197296334 | -3.0874886792026714 | -3.1533507541428243 | -3.0274937793783323 | -3.490387848589796 | -3.3933347259985167 | -3.3783932166170203 | -2.9587815147373986 | -3.0006060519147475 | -3.096681279204829 | |
| D-Glucose [-H(+)] | -3.196541274083026 | -3.345011461990021 | -3.2808422115196656 | -3.497768765865648 | -3.59592265378671 | -3.5691437048510277 | -3.561534485469992 | -3.506311031562751 | -3.5361759070623364 | -3.6734223763273763 | -3.5832051401001737 | -3.6059618522003163 | -3.6854693493132196 | -3.7078832978313927 | -3.686646112584335 | -3.6954656772678103 | -3.7113537247431547 | -3.75134410073754 | -3.778850425309451 | -3.7547190161125283 | -3.78834481058058 | -3.7255326305198384 | -3.752600551036485 | -3.7084023281680825 | |
| L-Tyrosine [-H(+)] | -6.2047637517129735 | -6.0975657798526175 | -6.191060873536335 | -5.734888984927373 | -5.660819012295574 | -5.6842396207652905 | -5.738618738374353 | -5.564819648708498 | -5.661725577338386 | -6.499990726361311 | -6.483526419493808 | -6.475860558599343 | -6.583965246576988 | -6.552019968717755 | -6.558073025550762 | -6.666491541707229 | -6.623333105459887 | -6.631349595049105 | -6.757786107124254 | -6.732818810661187 | -6.772025192126895 | -6.113142420806445 | -6.098469623707639 | -6.077118248489134 | |
| Mannitol [-H(+)] | -9.121471224441997 | -8.99741083531401 | -9.158680594725036 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.997418667661585 | -7.81133858464545 | -7.724831916552592 | |
| Choline phosphate [-H(+)] | 0 | 0 | 0 | -5.696248239461064 | -5.192154974554066 | -5.153031749349935 | -5.532679303910733 | -4.821843703056839 | -4.787923082826897 | -7.842259903270981 | -7.767058269371336 | -7.847589200464853 | -7.75916022786005 | -7.811494243943681 | -7.750659849697824 | -7.7987382253540165 | -7.813439328159292 | -7.760696570868667 | -8.09177879599488 | -8.055643602303133 | -8.076164172763033 | -6.050995707313099 | -6.113592666628056 | -6.067496610006642 | |
| L-Phenylalanine [+F(-)] | -7.667540961752124 | -7.710086114325123 | -7.8863058650012015 | -6.5384710993658945 | -6.748066572174567 | -6.559757284707692 | -6.684314130951693 | -7.283756096679999 | -7.088722829316039 | -7.988303035518321 | -8.281006927579229 | -8.16360176585082 | -8.275594678661705 | -8.185345066261203 | -8.17347804056056 | -8.68350688089128 | -8.550207911541605 | -8.281248618268839 | -8.662219080898533 | -8.715959714496208 | -8.629524214777248 | -6.996424470781976 | -6.973364313575958 | -7.085017735902844 | |
| 3-Phospho-D-glycerate [-H(+)] | 0 | 0 | 0 | -7.158873164964177 | -6.943396904758598 | -6.891862822542191 | -7.118775731472679 | -6.935277937350895 | -6.949080202217505 | -8.212325735341313 | -8.302507724886533 | -8.229300801215373 | -8.346599055597755 | -8.199377691669456 | -8.26796172192007 | -8.307958032847322 | -8.240231489861268 | -8.3359644886065 | -8.553536334550218 | -8.464122831721735 | -8.50751904592951 | -7.385990835486851 | -7.315442673665654 | -7.341860364500562 | |
| Pyridoxal [+F(-)] | 0 | 0 | 0 | -7.8825865056032 | -7.6125707944159995 | -7.610224177396658 | -7.904034702165257 | -7.549414322772558 | -7.684295876279772 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -5.7838917588744065 | -5.7355798649517356 | -5.907849759591215 | |
| L-Arginine [+F(-)] | 0 | 0 | 0 | -6.873392384330744 | -6.325409435941613 | -6.25443608069398 | -6.647279433131695 | -6.092221037679964 | -6.102597302241741 | -8.89222232257023 | -8.882509085378782 | -8.820419676912948 | -8.875825014204466 | -8.777415233008412 | -8.856843660516532 | -8.951102112598825 | -8.850078932427124 | -8.80363121206697 | -9.210185906239236 | -9.099232412559854 | -9.147830632509962 | -6.979797555643073 | -6.988770540929036 | -6.840957100507147 | |
| L-Citrulline [+F(-)] | 0 | 0 | 0 | -7.628110654067493 | -7.788035577593369 | -7.8207440887666335 | -7.746690376827825 | -8.043897337207035 | -7.977127412322882 | -8.779186656556586 | -8.643449105925004 | -8.707439935188686 | -9.14294454427525 | -8.872799163027217 | -8.985976125327129 | -9.075287553363854 | -8.97888247735402 | -8.989753703703226 | -9.640825555413109 | -9.548518388967452 | -9.495988147720286 | -8.677917332281021 | -8.585253215640568 | -8.657337506905687 | |
| Ascorbate [+F(-)] | -7.778209453864146 | -7.525849090347891 | -7.7191893593885315 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| D-Erythrose 4-phosphate [-H(+)] | 0 | 0 | 0 | -6.137560288868956 | -5.60367916984848 | -5.559872682474194 | -6.11308054456979 | -5.723335984572618 | -5.69298374832122 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -6.6468403542768195 | -6.209620351695582 | -5.851771273005473 | |
| D-Glucose [+F(-)] | 0 | 0 | 0 | -6.92538400845039 | -6.684689076127144 | -6.721977736860517 | -6.916357826426118 | -6.602141912522866 | -6.7163675458568015 | -7.654688655845099 | -7.569685294603612 | -7.593282892203302 | -7.733406323650061 | -7.691235636724027 | -7.744884161962989 | -7.656189309705348 | -7.719785322175728 | -7.764968237462492 | -7.99030528738274 | -7.938295246554796 | -8.027184624303812 | -7.267154953168097 | -7.21849081404128 | -7.204643880369403 | |
| L-Tyrosine [+F(-)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.436486211796144 | -8.500800884003578 | -8.545674385115689 | -8.510557325641475 | -8.490899418209686 | -8.467158669352472 | -8.449720168213807 | -8.451640487159974 | -8.547032305487583 | -8.929890952409696 | -8.861455192429695 | -8.831288891114019 | -7.21503974091959 | -7.152505904098716 | -7.124011214151178 | |
| Mannitol [+F(-)] | 0 | 0 | 0 | -4.340147008654491 | -4.09552672152396 | -4.074956897145969 | -4.077981971750111 | -3.886306821071062 | -3.9013990005517694 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -5.266270712020197 | -5.17053631275229 | -5.2175435893446656 | |
| Choline phosphate [+F(-)] | -3.7035645669580775 | -3.8241447391751437 | -3.7438182203435244 | -3.630138259511104 | -3.707431590730229 | -3.744430059659368 | -3.626274936573583 | -3.490153362490177 | -3.5786305604278024 | -4.1125418277490375 | -4.096662356144627 | -4.133337623520207 | -4.230917684184907 | -4.184430350348913 | -4.212934321574475 | -4.24085808152198 | -4.223513138249633 | -4.256770253496109 | -4.327970108101582 | -4.261998397522385 | -4.331364335020693 | -4.275184868215918 | -4.315134365524832 | -4.302483043287711 | |
| L-Tryptophan [-H(+)] | -8.935009740033422 | -8.797697012384333 | -8.863763006830759 | -7.90317126017597 | -7.823796190468768 | -7.824967989963263 | -7.916631737559693 | -7.800481147838122 | -7.826596309141833 | -9.277704816392658 | -9.350949060716108 | -9.26856931050472 | -9.38885002523444 | -9.318850207552199 | -9.328129113988844 | -9.11298775528515 | -9.246118042762344 | -9.352626755130377 | -9.68062736605535 | -9.569219490247093 | -9.624587659741556 | -8.68894730343745 | -8.633848875727374 | -8.734430636769508 | |
| Lipoamide [-H(+)] | -8.802597582280235 | -8.830743756604722 | -8.78098244199581 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.27660825502532 | -8.321983484474075 | -8.30066086536778 | |
| Dihydrolipoamide [-H(+)] | -9.735276655771134 | -9.80815149981015 | -9.754862780396039 | -8.053575555459942 | -8.164817160992165 | -8.175559257330473 | -8.188878329217733 | -8.24260766105552 | -8.17902456441831 | -9.621752488165875 | -9.462914798805505 | -9.611396557957939 | -9.621794239678131 | -9.557861242447547 | -9.618391291730461 | -9.810805742027533 | -9.743003088589202 | -9.714799151540708 | -9.629937956084472 | -9.64479333928369 | -9.780575343392552 | -9.488609561158311 | -9.496897321316185 | -9.539687856142269 | |
| 2-Deoxy-D-ribose 1-phosphate [-H(+)] | 0 | 0 | 0 | -7.1049849034492905 | -7.007515075647799 | -6.8533632011677 | -6.923766303961103 | -6.572952692245485 | -6.730749485583409 | -9.156726418759693 | -9.070131425820875 | -9.149916598532343 | -9.07237155481739 | -8.98159193928134 | -9.101825103299298 | -9.124891241435574 | -8.971289468329925 | -9.10637878763591 | -9.323341724104313 | -9.370202385494428 | -9.294418871308185 | 0 | 0 | 0 | |
| L-Tryptophan [+F(-)] | 0 | 0 | 0 | -7.688480197172639 | -7.537159520167698 | -7.60341250373144 | -7.696619517034412 | -7.639232782342082 | -7.65753550865289 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.466558693251944 | -7.045000227013752 | -7.258568145824668 | |
| Lipoamide [+F(-)] | 0 | 0 | 0 | -7.293073042231052 | -7.142445308500841 | -7.171652929472732 | -7.295274079574817 | -7.185884703032637 | -7.181022335794182 | -8.66322055796153 | -8.714989658290696 | -8.73408620057706 | -8.736900008883874 | -8.615597488916366 | -8.724726444709763 | -8.598614705954057 | -8.373896094711085 | -8.518292161933415 | -8.800577743672392 | -8.872164333568522 | -8.807102678453376 | -7.721159959130429 | -7.635719789519538 | -7.665742719817141 | |
| Dihydrolipoamide [+F(-)] | 0 | 0 | 0 | -7.175784517204704 | -6.99513760049781 | -6.954263423889938 | -7.044721612418819 | -6.788457914736089 | -6.8819985530416705 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| Deoxycytidine [-H(+)] | -8.782768744558862 | -8.639856628909516 | -8.814969524960794 | -6.748936049799735 | -6.68407830624219 | -6.675314946359299 | -6.748936049799735 | -6.68407830624219 | -6.714336645456721 | -8.162616423081982 | -8.104345250265386 | -8.14949038062706 | -8.261424636225554 | -8.195621522921863 | -8.233779807184256 | -8.273183804581329 | -8.327081398346913 | -8.25418965482556 | -8.521648241232487 | -8.518433671720999 | -8.476950238237908 | 0 | 0 | 0 | |
| Deoxyuridine [-H(+)] | -7.231015688384458 | -7.204689236634753 | -7.065399507629513 | -7.056525971358288 | -7.089881222818503 | -7.106723209388083 | -7.252945712598571 | -7.238013753833162 | -7.319213045004391 | -6.384271416444518 | -6.3332416027886325 | -6.418965638362561 | -7.828866606274974 | -7.707861792566448 | -7.647649513932169 | -7.464420382502408 | -7.53776995019232 | -7.640443213962843 | -6.660593784653745 | -6.742372031793781 | -6.6561750714254035 | -7.542767153943504 | -7.62277481502076 | -7.64128453346642 | |
| D-Ribose 5-phosphate [-H(+)] | 0 | 0 | 0 | -4.142304922518978 | -4.129186597143695 | -4.200580862283682 | -4.107788568561293 | -3.977496103826664 | -4.027975826794087 | -5.003504466085388 | -4.94465053482725 | -4.887636907569254 | -4.846491972220256 | -4.77343259150186 | -4.820040980815756 | -4.801721137064319 | -4.850896092496962 | -4.840940321843366 | -5.030204586444642 | -5.083594585515419 | -4.97323205570363 | 0 | 0 | 0 | |
| Thymidine [-H(+)] | -6.238260198607948 | -6.328437488176069 | -6.180863125266706 | -6.023862126994448 | -6.041840066611634 | -6.023441656069016 | -6.0445991208087335 | -5.9601731147414885 | -5.969553539638369 | -5.9861861489411154 | -5.913538809466534 | -5.977957056032157 | -5.763641082457288 | -5.72885304726958 | -5.772520643715302 | -5.681775057840854 | -5.71366595770548 | -5.641450497951018 | -6.329286582036286 | -6.342928954275779 | -6.383157379722686 | -5.785992011748126 | -5.776204164125204 | -5.848635650936372 | |
| Cytidine [-H(+)] | -5.21740379203299 | -5.221913052650581 | -5.158620641510281 | -5.201205134536563 | -5.183120283603904 | -5.220770867198192 | -5.192848810530849 | -5.086958901965314 | -5.0980941986905925 | -5.405869273565634 | -5.339417373720593 | -5.384136368443165 | -5.320719473459217 | -5.2670773585772865 | -5.292204990824878 | -5.277119390517711 | -5.183206788428924 | -5.244895735926911 | -5.742936845553375 | -5.74618260325939 | -5.797725615987848 | -5.606430565498107 | -5.646374736191476 | -5.672755706195441 | |
| Uridine [-H(+)] | -11.282574561339757 | -11.132839441694887 | -11.399730589093501 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.952784292419159 | -8.833010916538026 | -8.957201287273925 | |
| Pyridoxal phosphate [-H(+)] | 0 | 0 | 0 | -6.675107358542065 | -6.493014478166364 | -6.4160398996367585 | -6.532781575687398 | -6.287049894938442 | -6.3428812567638175 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.195838895958363 | -7.19164032691754 | -7.203586098314082 | |
| Deoxycytidine [+F(-)] | 0 | 0 | 0 | -3.712610083351897 | -4.42044640462899 | -4.451759790986516 | -4.100157728189299 | -6.461655577145255 | -6.124495571601458 | -7.630207404077714 | -8.083096535234574 | -7.899050507605416 | -7.56503386667401 | -7.460514049192014 | -7.565668507776813 | -6.891924513700434 | -6.577581301516835 | -6.702386339081501 | -7.210868655584077 | -7.094528415374773 | -6.987633477947853 | -2.7246322028276775 | -2.7370548437053444 | -3.001437481138572 | |
| Deoxyadenosine [-H(+)] | -7.6460295038865365 | -7.646326385275101 | -7.641443246329798 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| sn-Glycero-3-phosphocholine [-H(+)] | -7.022867662631217 | -6.987245029010908 | -6.837997125250899 | -5.508429911569413 | -5.778877743345009 | -5.641459453740556 | -5.8141647838783355 | -5.975015676330222 | -5.813713376929897 | -6.520286065606231 | -6.534936378731221 | -6.495238393721346 | -6.562123965417895 | -6.4358942187820185 | -6.52468912241884 | -6.855173518532016 | -6.869198266266585 | -6.932123735613407 | -6.858446908319834 | -6.7739112076909755 | -6.796334682434774 | -6.285576387866309 | -6.2549620859224655 | -6.233070956597352 | |
| D-Fructose 6-phosphate [-H(+)] | -7.262205914804042 | -7.00277027131605 | -7.23824886074793 | 0 | 0 | 0 | 0 | 0 | 0 | -7.639902932365287 | -7.692018013279451 | -7.753225551024932 | -7.72480423745741 | -7.809736100545859 | -7.793753100411459 | -7.717587882148253 | -7.622696296643925 | -7.72348261445175 | -8.016636016164519 | -8.008531133821563 | -8.11051605202299 | -5.330217520231282 | -5.194475921892718 | -5.317565098114204 | |
| D-Mannitol 1-phosphate [-H(+)] | 0 | 0 | 0 | -6.049707535548487 | -6.077317522667036 | -6.094691870298981 | -5.991736758051458 | -5.815969776346818 | -5.845496840536441 | -5.552775172343418 | -5.367792746500429 | -5.490427898836091 | -5.3781770552647234 | -5.394582442929787 | -5.3854176074199325 | -5.516183776659279 | -5.552685420431847 | -5.625541289549982 | -5.873658839216754 | -5.840974866332786 | -5.754091468105086 | -6.290503332105142 | -6.343481221632352 | -6.362236375493559 | |
| Thymidine [+F(-)] | 0 | 0 | 0 | -7.020711690018953 | -6.8845307671279965 | -6.798557278760138 | -6.921515608596275 | -6.357756800080358 | -6.538689552067267 | -7.974098559720039 | -8.08440243133375 | -8.004764381530162 | -7.820720765214848 | -7.75474523901041 | -7.778486800481105 | -7.637137010783343 | -7.550744505719543 | -7.629100775370408 | -7.964601244718919 | -7.916588672287396 | -7.905533960556101 | -7.385376448443126 | -7.46817685873213 | -7.513633529499887 |
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| 261.043 | D-Mannitol 1-phosphate [-H(+)] | cpd:C00644 | -7.431176847181099 | -7.751434008365258 | -7.786324556016876 | -7.909104013942522 | -7.758240641461027 | -7.472557956755901 | -7.485313766209591 | -7.794444469722845 | -7.7095364212816015 | -7.649543496732599 | -7.4534896918922735 | -7.56424891095938 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.584562523835601 | -7.767315616771988 | -7.981156208919252 | -8.04619254089209 | -7.876539291835214 | -7.977673935051247 | -7.774496372399628 | -7.636086871290811 | -7.668816561460853 | -7.984982176298169 | -8.103272941738147 | -8.085622699085986 | -8.165161434924611 | -8.012267796071193 | -8.19092207676077 | -7.882382836962359 | -8.053920142213366 | -8.077192342553468 | -7.606450415158337 | -7.613001101353481 | -7.608893517688978 | -7.665427219094527 | -7.535355160087975 | -7.951314897271115 | -7.966741228964965 | -7.612098921092924 | -7.943803751100527 | -7.809736100545859 | -8.05360140339259 | -8.402230909468358 | -7.9885211756245065 | -7.840997219030903 | -8.020365797797021 | -7.896417207164575 | -7.688032055088215 | -5.116555187822785 | -5.598120214117893 | -5.134653713615922 | -5.143590817113355 | -5.443089227243258 | -5.708662184938212 | -5.570025198112746 | -5.610432476964766 | -6.056765013357642 | -5.471863754150995 | -5.194475921892718 | -5.279169373715825 | -5.044404299958544 | -5.539610259064876 | -5.242603791767137 | -5.65001097699603 | -5.096435722806839 | -5.100820697125597 | -5.443123891766895 | -5.238888481007324 | -4.918925974333964 | -5.339733598272124 | -5.108786296792658 | -5.547034072437936 | -5.330217520231282 | -4.710512363419574 | -5.554565317981636 | -5.421939498634037 | -5.553469628679571 | -5.8254742102984896 | -5.090980361697302 | -5.700957223597371 | -5.308700434163207 | -5.832159957117528 | -5.440958785462751 | -4.8360855906162294 | -5.220241744402077 | -5.509571657611553 | -4.254816452753586 | -4.360247189757557 | -4.148434144686696 | ||||||||||||
| 261.088 | Thymidine [+F(-)] | cpd:C00214 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -6.778358974586717 | -6.9835126348901 | -7.161621264418454 | -6.986694142970844 | -6.834567255167131 | -6.980376619590096 | -7.201835419412556 | -7.018665439113835 | -7.177441438290025 | -7.229737368506355 | -6.850656815630162 | -6.840655381952415 | -7.190474870763587 | -7.066048637251473 | -6.944029070679676 | -6.118490945722545 | -6.257618823411851 | -6.06200468921018 | -5.665395542848249 | -6.260730612215588 | -5.940000252952008 | -6.095946468959634 | -6.312466294656853 | -6.350248386179915 | -6.240437091365602 | -5.895178183015539 | -5.992939925468376 | -6.1051753064285235 | -5.806145597931681 | -6.05918871226319 | -6.194251601138986 | -5.876462520172595 | -5.911972386880582 | -6.146051209404581 | -6.043055467578453 | -5.914994967330499 | -5.8233183727851126 | -5.891807490205558 | -6.1428856107884275 | -6.152569845809382 | -5.957592508003169 | -5.319761838611488 | -4.9939815530511185 | -5.163341182934799 | -5.285331849282679 | -5.404407753372472 | -5.563687803839268 | -6.053709576494116 | -6.305829098176633 | -6.061103655489216 | -5.994012093463389 | -6.098204947051663 | -5.744310620596926 | -6.554686139673745 | -5.863737432365926 | -6.2231240242673715 | -6.43129714912526 | -6.055826491211622 | -6.059548521367227 | -5.2667125449535925 | -5.278901221099629 | -5.473340888259437 | -5.487015733099341 | -5.49775858154044 | -5.485086924096752 | -5.535968024813948 | -5.648665648551958 | -5.558668954471183 | -5.3233318657464945 | -5.799710838937123 | -5.4489004612718475 | -5.444152000508532 | -5.379813006092788 | -5.367505037319394 | -5.55545906556117 | -5.5804957633079475 | -6.0621017188939055 | -6.139954857976465 | -6.052836330648172 | -6.390993373945564 | -6.059515752346765 | -6.219006636417946 | -6.357554723641963 | -6.247029791965837 | -6.1706549664153965 | -6.290503332105142 | -6.333176110523562 | -6.258120135630051 | -6.335901418628889 | -6.224420039615941 | -6.345182787477234 | -6.176235930975157 | -6.351780161881443 | -6.112864731354332 | -5.985868776793116 | -6.40337342255405 | -6.432159597028706 | -6.406566268809193 | -6.434575814087828 | -6.4228368842348775 | -6.21649934084293 | -6.243825058476603 | -6.425605008243072 | -6.475245378964399 | -6.402210546397611 | -6.308602605390491 | -6.041111820485375 | -6.169493810816927 | -6.407399264085505 | -6.360848935355017 | -6.414889838519837 | -6.3413075816377384 | -6.324958096771577 | -6.366775901505644 | -6.389958085205218 | -6.140841403528515 | -6.32267162560361 | ||||||||||||
| 264.107 | Thiamine [-H(+)] | cpd:C00378 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.033934025331313 | -7.394963428077032 | -7.042698751613213 | -6.32696741393846 | -7.200937578731991 | -6.8001551942062335 | -7.276413506839175 | -6.952279315873145 | -7.278077557151703 | -7.037462332415062 | -6.542901451198658 | -6.939117634282722 | -7.249516382847012 | -6.354418458350585 | -7.162167522159357 | -7.264451804955383 | -6.705425474690883 | -6.705164310615979 | -7.133707141930221 | -6.958701287381197 | -6.961088185312314 | -6.7549834660430506 | -6.641139563802482 | -7.223532203843035 | -7.1178017700608684 | -6.900206099621686 | -7.964211102105967 | -7.683722411415232 | -8.034720926490246 | -7.72281751580133 | -7.562707123303017 | -7.743664502420254 | -8.143719281182925 | -8.12859029215158 | -8.313015291281905 | -7.408635824517264 | -7.877568831622976 | -7.539952208484949 | -8.231755732565489 | -7.52843649964627 | -7.842347237824534 | -7.844549941752615 | -7.527654647835812 | -7.367820366004332 | -7.959198454261869 | -8.047013625480218 | -7.603482148825383 | -7.839547444848813 | -7.75474523901041 | -7.8754579262497195 | -7.934824494894812 | -7.746879300061594 | -7.735574867378077 | -7.713724791344816 | -7.590259169855945 | -7.271118717729713 | -7.700455627838715 | -7.8635958438934495 | -7.501016510169017 | -7.814879595424698 | -7.817045126405863 | -7.55432928703417 | -7.494588411474938 | -7.169052458006551 | -7.266611911366994 | -5.143669952257081 | -7.000050210156804 | -7.462413004217973 | -7.556604367113435 | -7.540808979506078 | -7.536304978536997 | -7.519644001294429 | -7.33189883970914 | -7.390633916791466 | -7.154834420093215 | -7.603180437636055 | -7.442679083656615 | -7.280470408458583 | -7.39506605929414 | -6.9151453065052 | -7.664328824742193 | -7.160214342029059 | -7.600012594164041 | -6.977811147279537 | -7.607477594424304 | -7.192829552832489 | -6.75855256897329 | -7.757182349945133 | -7.757693160312952 | -7.671181323754882 | -7.70226485676654 | -5.429132407488429 | -7.191459818237318 | -7.513633529499887 | -7.246029421466521 | -7.627552379411634 | -6.669882195444489 | -7.5820300506905 | -7.711480087696428 | -7.7263274521789045 | -7.485456289803066 | -7.507765621618973 | ||||||||||||
| 264.95 | 3-Phospho-D-glyceroyl phosphate [-H(+)] | cpd:C00236 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.415083267384938 | -8.662421654463735 | -8.66728551712044 | -8.691686946183893 | -8.482388343358346 | -8.599947844736914 | -9.005355684844744 | -8.633299458816616 | -8.928893740075969 | -9.2133322822674 | -8.385094049585636 | -8.74789338755813 | -8.445090759236022 | -8.531348745083458 | -8.658655370751953 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 266.023 | Pyridoxal phosphate [+F(-)] | cpd:C00018 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.1176140038679 | -8.844948694297157 | -9.25166580771602 | -9.475973109851347 | -9.245317425517847 | -9.355835147680372 | -8.53605977266804 | -9.042360225053997 | -8.526249564724429 | -9.039243315236446 | -9.022377524089988 | -9.501733160158768 | -8.84340557552733 | -9.253536450266198 | -8.53770705988029 | -8.628573585783906 | -7.83206594480774 | -9.500876549652007 | -8.585949601764659 | -9.263267318296295 | -8.91988941494786 | -8.332689553847612 | -9.398390724940144 | -8.795450365549073 | -8.3995983587318 | -9.076568189028514 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.161635333589055 | -9.694743365141525 | -8.833625902643195 | -9.066235475200909 | -9.017526419687957 | -9.155707783751904 | -9.064298108832293 | -9.348246456070813 | -9.545834494500937 | -9.566356450003918 | -9.088087091929037 | -8.828414369543212 | -8.716356465906577 | -8.835752145290364 | -9.049408231927709 | -8.907666688364948 | -8.500162346192097 | -8.884318900505479 | -9.224410476144023 | -9.557678282562172 | -8.665696661944505 | -8.887701974890852 | -8.792170377539616 | -9.141972043902836 | -9.066548906449217 | -8.193635961578906 | -9.678203514226647 | -9.36458323909623 | -9.501308594020438 | -9.688133721056042 | -8.11874510542273 | -9.07579883823553 | -9.024610421123281 | -9.116186085821939 | -9.17320184746676 | -8.213322170723938 | -9.706698779115438 | -9.75307417014594 | -8.471870512315991 | -8.521645304857273 | -8.1225532767471 | ||||||||||||
| 266.089 | Adenosine [-H(+)] | cpd:C00212 | Deoxyguanosine [-H(+)] | cpd:C00330 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -6.155480734835055 | -6.8734961650569755 | -6.540768612225452 | -6.286114655991238 | -6.746769999366248 | -6.560491852932526 | -6.334746366548367 | -6.479130689741386 | -6.853159556363775 | -6.459173930456857 | -6.435211031890588 | -6.817610574213306 | -6.5821473051133825 | -6.407866234387192 | -6.254426858950722 | -6.134554036303954 | -6.4424072234815055 | -6.442870507796463 | -5.705026557216793 | -6.493452180288477 | -6.097369972574922 | -6.268796121616015 | -6.506381374721662 | -7.0446054876750415 | -6.614295645443034 | -6.048787934191249 | -6.3497093432498435 | -6.538951295232751 | -6.459295309540348 | -5.6516678853432465 | -6.200870743524525 | -5.825480947622111 | -6.2776385033709 | -6.09328904783828 | -6.196980049413478 | -6.332940096733292 | -6.00533210174333 | -6.3191565997233425 | -6.296293087293709 | -6.695075406663034 | -6.084946119536933 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||
| 270.098 | Deoxyadenosine [+F(-)] | cpd:C00559 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.264114047031034 | -8.234177279581122 | -8.024917309503893 | -8.045568726745344 | -7.685986448320389 | -7.8012547805058094 | -8.22096527129935 | -8.344635936474575 | -8.37493509608674 | -8.363470347616675 | -8.17825280935549 | -8.019796740469022 | -8.111340550796898 | -8.058405383456822 | -8.07268456927372 | -8.24142824359482 | -8.022873966739146 | -8.062650355413485 | -8.228257729450261 | -8.244855097262565 | -7.9495369994092515 | -8.292166020822023 | -7.897158339293484 | -8.39936646316848 | -8.079409439378951 | -7.6676695778213775 | -8.271916160008868 | -8.351988606913649 | -8.299094182307257 | -8.43881575312556 | -6.997214350933466 | -8.303098422265471 | -8.184081352296483 | -8.151815175699795 | -8.206691550723523 | -7.588360165528818 | -8.245616703329151 | -8.341502141126123 | -8.015300384430322 | -8.00554731490611 | -7.923306425182328 | ||||||||||||
| 273.005 | 3-Dehydro-L-gulonate 6-phosphate [-H(+)] | cpd:C14899 | -11.852482570665961 | -12.172430918712081 | -11.774473817400336 | -11.613159414090383 | -12.019886701818102 | -11.558551435257124 | -11.141771734583779 | -11.23813909863156 | -11.58029517574 | -11.761221517890592 | -10.956337040137672 | -11.731089301338635 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -10.187863746895433 | -9.571145258293019 | -9.892047245434918 | -10.524313376181661 | -9.671084465148253 | -10.070652166714142 | -9.327173758647307 | -9.292529823342123 | -9.444361413147776 | -9.837481103525464 | -9.921890825052241 | -10.197707181741055 | -9.80355922159273 | -9.606779432282076 | -9.658124767530376 | -9.317558448119982 | -9.677403132463496 | -10.058321541843105 | -9.215891453459953 | -9.969114798612079 | -9.804671347627462 | -9.639570874073698 | -9.79459687089378 | -9.42700877177416 | -8.725831962833007 | -9.621277051720776 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -10.573009453140475 | -10.48199953118719 | -9.975620006066501 | -10.298685121537067 | -10.119120486222105 | -10.299351508870068 | -10.345437968881013 | -10.55271900210677 | -10.49374372549332 | -10.615985787193468 | -10.300505552172456 | -9.949068998379625 | -10.054549562177348 | -10.179873121724091 | -9.95703400683514 | -10.119162728588217 | -9.773308457160722 | -10.157643803644753 | -10.491448137801092 | -10.275071766058387 | -10.165561449775213 | -10.063677587638914 | -10.059236228737676 | -10.502284592170438 | -10.111718416931097 | -9.71287303086536 | -10.45342675634105 | -10.412407576396362 | -10.382393121368125 | -10.632855767543681 | -9.589282752913315 | -10.207409634536326 | -10.0858533093361 | -10.326559199247617 | -10.315465105033319 | -9.259863623404863 | -10.435015411365217 | -10.484019814691715 | -9.726822711230604 | -9.730001900875763 | -9.399067187637991 | ||||||||||||
| 277.107 | sn-Glycero-3-phosphocholine [+F(-)] | cpd:C00670 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.291760509758149 | -8.150772374343447 | -7.874260978073978 | -7.994509267094784 | -7.546351508920095 | -7.899661464515477 | -8.332276317625077 | -8.371445335373561 | -8.248798928031142 | -8.35298703249603 | -8.176296283796168 | -8.088919661967163 | -8.2108887406269 | -8.08053157576313 | -8.249956504792493 | -8.251680689826268 | -8.205348064045149 | -8.15323703104496 | -7.994470135385651 | -8.544548079881585 | -8.084926273839011 | -8.451835566884823 | -8.003386675864785 | -8.403529396017648 | -8.056568808891864 | -7.642636136365056 | -8.363263648312365 | -8.381224721384525 | -8.318193565428144 | -8.523902302270407 | -6.856714646131761 | -8.186534153415447 | -8.378895565677867 | -8.181967773797338 | -8.219037307800818 | -7.556519911359683 | -8.326678106063895 | -8.48980428952011 | -8.383201784007676 | -8.288441510352381 | -8.333580601965775 | ||||||||||||
| 277.123 | Pantetheine [-H(+)] | cpd:C00831 | -7.53242337551455 | -7.549124415691312 | -7.795846817418774 | -7.200667584534411 | -7.057600386599189 | -6.954894393257849 | -6.93799250373761 | -6.8019017482914945 | -7.133941434769462 | -7.073255911562342 | -7.482260593919613 | -6.886788790785034 | -7.094718155417315 | -7.247717852391331 | -7.317352572362977 | -7.207583655246812 | -7.145047736370555 | -7.05598160517592 | -7.5756015845648665 | -7.064227237580406 | -7.356781385134927 | -7.532864940439075 | -7.317434694535603 | -7.20967270073753 | -7.523406023205345 | -7.247836694590861 | -7.295224310649111 | -6.865352704598311 | -6.9825175848128795 | -6.911195642687098 | -6.3463512828358635 | -6.973525237841921 | -6.733785595840162 | -6.9037116758016275 | -6.927686537086921 | -7.2327745389362885 | -6.837724121770915 | -6.579087150143416 | -6.78518272493045 | -6.913439585797961 | -6.348100373810337 | -7.012943433881883 | -7.0663966013471855 | -6.618333222432829 | -6.680805185667 | -6.963601581334745 | -6.8978218730122745 | -6.780132262465552 | -6.524234442436806 | -6.675635550733536 | -7.112964928343598 | -6.929687393501649 | -6.712074321096227 | -7.278771763327687 | -6.887547242898079 | -7.1652505419576435 | -7.047630966957677 | -7.3198476754674235 | -7.316341779757624 | -7.611620195289709 | -7.750373792638078 | -7.647333847266283 | -7.28273437588544 | -7.895028927016942 | -7.524305184149987 | -7.767238940396143 | -7.919361627253958 | -8.106850606271815 | -6.477267558072369 | -6.038032306365116 | -6.03843637730957 | -6.986541994426916 | -7.117375586253214 | -7.024937581336383 | -7.343695530287642 | -7.114660588047675 | -7.248819508022955 | -7.260892412802667 | -7.298336889412054 | -7.062362779144835 | -7.102280759472051 | -7.295207011461389 | -7.256558557862377 | -7.164460945307905 | -7.084759306824885 | -7.248922196923072 | -7.233894939558831 | -7.230393102901617 | -7.133599212731267 | -7.127133064718131 | -6.848508071353907 | -6.865693562345849 | -6.4940657726429105 | -6.634830117715464 | -6.735801260203469 | -7.048592331323971 | -7.215865233958206 | -7.269547585029777 | -6.944004756767753 | -6.938191613616642 | -7.303695907479746 | -7.016967417768504 | -7.0965198237864735 | -6.99489123889894 | -6.865539074944099 | -7.133843395946355 | -6.896105893927052 | -7.232301911960905 | -6.973755165770145 | -7.142743450738004 | -6.869969920074941 | -6.90741431968849 | -6.891786642137735 | -6.584902562040573 | -7.219255198017308 | -7.0807081139539 | -7.246849401696308 | -7.2197510650313115 | -5.540886809194358 | -6.9642017033666725 | -7.258381602750348 | -6.496940372855453 | -7.378714237056649 | -6.703829472703214 | -7.337248893326715 | -7.3077333045775985 | -6.652027179009629 | -7.017144156512013 | -7.050074016195058 | ||||||||||||
| 282.082 | Guanosine [-H(+)] | cpd:C00387 | -6.4976572503160135 | -6.134908957673279 | -5.570295709971366 | -7.002110232503091 | -6.878488536203308 | -6.835658775285981 | -6.820661483144342 | -7.115714041312833 | -7.385155212040654 | -7.88866869148059 | -8.09526359062479 | -8.020989386690395 | -5.881090694678154 | -7.68840483286267 | -6.7595757320999885 | -6.305064257866034 | -6.30561850886534 | -6.956171560465854 | -6.666534289231542 | -7.183252870332395 | -7.740354834831463 | -6.514436559648904 | -5.278589041992458 | -5.95157586256539 | -5.634907697027496 | -5.497241131381766 | -5.502416191575416 | -6.498310499465023 | -6.593655072908706 | -6.452445092261853 | -6.2751955488248115 | -6.586758988875523 | -6.292205295324232 | -6.5029362106932185 | -6.687999373422778 | -6.671776185791873 | -6.290693430075592 | -5.8761680142431905 | -6.44703114896115 | -6.464555887778738 | -6.270465568409157 | -6.592897228991755 | -6.59848287833929 | -6.384633926834664 | -6.312808971363781 | -6.549992022581335 | -6.5549263763459376 | -6.449164358847776 | -6.304394182431374 | -6.4372735563594015 | -6.634612351412809 | -6.438883546961755 | -6.4234855126912445 | -6.046995197525191 | -5.855922212059525 | -5.9803642519131595 | -6.128088954264338 | -6.257913840059078 | -6.0332202040492025 | -6.20874553568751 | -6.34788247296214 | -6.3731708797838555 | -6.404552958402934 | -6.586339113129681 | -6.518567652907015 | -6.667283527806183 | -6.71501111577288 | -6.747548683073083 | -6.225933129739869 | -6.066722739898143 | -6.157420942687267 | -6.169853362921974 | -6.281010265316118 | -6.000613868606785 | -6.203055089685101 | -5.923563680766745 | -6.308018435277885 | -6.035845890741225 | -6.406800506375524 | -5.976736525945533 | -6.005715094524112 | -6.109144827010183 | -6.254610321646636 | -6.325634229009889 | -6.3282637971094315 | -5.999763882475314 | -5.944276111969568 | -6.174139414837771 | -6.796325902220359 | -6.842850514763982 | -6.773064525442086 | -6.677431506319817 | -6.43493018821464 | -6.685935482481954 | -6.469541366909047 | -6.565283117935127 | -6.653150800224904 | -6.408651963100027 | -6.340404906697461 | -6.359904375533246 | -5.9339667963089155 | -6.440908358351249 | -6.248462409032791 | -6.099597177583191 | -5.93259521522595 | -6.016265274978893 | -6.065145566489842 | -6.469783977612012 | -6.587444106512084 | -6.8066964180128595 | -6.733285699536684 | -6.972517229733078 | -6.63395767040193 | -6.3990245578216225 | -6.472232583078091 | -6.635857880618184 | -6.818848469228175 | -6.57059929635411 | -7.312726353454808 | -6.876830112751147 | -6.644556193308345 | -6.730377701013777 | -6.738232866001629 | -5.768703717722432 | -6.3988782671867135 | -6.501036880549694 | -7.061104870855834 | -6.864050755456695 | -6.817006790388745 | ||||||||||||
| 284.106 | Thiamine [+F(-)] | cpd:C00378 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.091417005739926 | -7.019644255358294 | -6.86801638667561 | -6.736015893211678 | -7.084439145670085 | -6.90993736785456 | -7.118476622788554 | -7.0192655012841465 | -7.1675621852656235 | -6.961128439171555 | -6.6679211094590265 | -7.027261733821762 | -7.079783552873754 | -6.704193350483151 | -7.16572377271921 | -6.819575213105228 | -6.8044859186765425 | -6.733462606409074 | -7.211814295392402 | -6.980206107558741 | -6.801962638234148 | -6.634391695590946 | -6.735039576269834 | -6.980739907765372 | -7.210542058428452 | -6.760740340021591 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 284.96 | 3-Phospho-D-glyceroyl phosphate [+F(-)] | cpd:C00236 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.897912557679417 | -8.756970733732683 | -8.802084117471303 | -9.463235101708507 | -8.735579190869315 | -8.714457243092934 | -8.117982373346308 | -8.636403279941366 | -8.57565475676238 | -8.79060541853491 | -8.885724708534305 | -8.776392087331061 | -8.491288942370959 | -9.010561833654767 | -8.837946260632206 | -8.681241240152287 | -8.677583944569827 | -8.753335535074411 | -8.327652506593859 | -9.06473624290208 | -8.56623897812277 | -8.858474482749143 | -8.966937022479526 | -8.8207981217627 | -8.460776517621168 | -9.096217116960256 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 286.094 | Adenosine [+F(-)] | cpd:C00212 | Deoxyguanosine [+F(-)] | cpd:C00330 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.898160504183833 | -8.825724626701334 | -8.842271785037136 | -9.030772012964615 | -8.458777462551982 | -8.727401851691994 | -8.999456358552013 | -8.92245847549468 | -9.187683924458371 | -9.063710623011302 | -8.32181051492081 | -8.786861065799703 | -8.51530727168707 | -8.654911468862485 | -8.93291246942145 | -7.747053022751129 | -7.789763392929154 | -7.604195048183339 | -7.124421385068327 | -7.735649142605887 | -7.5318420142037 | -7.524028670046151 | -7.717238515408346 | -7.7278130675942895 | -7.739251009417255 | -7.373485536366242 | -7.501128886233322 | -7.676013761743506 | -7.236553586265911 | -7.459467411372235 | -7.486211490131482 | -7.273272391241343 | -7.472526532619559 | -7.6939225183245705 | -7.588308538033279 | -7.451648907597641 | -7.340359005932582 | -7.442452862455726 | -7.623217469297159 | -7.56666756777035 | -7.419826778118243 | -8.018843673870057 | -7.783549035979779 | -7.888967243944333 | -7.779740450217402 | -7.605706880238028 | -7.636742716246584 | -8.190146666524752 | -9.342323499385794 | -9.221024481917503 | -8.020687840843921 | -7.927904445425482 | -7.760268630165105 | -9.53490511752849 | -9.156833075903771 | -9.505154710696885 | -9.344925154661587 | -9.248960477080994 | -9.355639497558558 | -7.943272560843462 | -7.799891149884755 | -7.541483163406857 | -7.841723440105161 | -7.829885116690108 | -7.736280031637408 | -7.564298794694504 | -7.832941209201335 | -7.6288108648516175 | -7.839052084427025 | -7.803040863391544 | -7.55020844774283 | -7.764173176818967 | -7.515562617241375 | -7.741151505585266 | -7.908816173938621 | -7.672007499768884 | -7.592485164234525 | -7.576038937607416 | -7.373360829636678 | -7.795649690316665 | -7.885848250007128 | -7.566253824746064 | -7.670041197941204 | -7.544492396885231 | -7.599118335218824 | -7.389117130591889 | -7.825938064237136 | -7.712770683064054 | -7.744418349989166 | -7.548370603532936 | -7.8576592691314 | -7.664833766353306 | -7.559422965262864 | -7.55201505829288 | -7.36067231470432 | -7.892016439319068 | -7.195120450115192 | -7.707383541920309 | -7.490753454123606 | -8.104910257717048 | -7.784944919921675 | -7.334434412003055 | -7.968575188337229 | -8.058309559795143 | -7.88335160075094 | -7.664733375940602 | -6.460233194406844 | -7.629312786692109 | -7.928718836057848 | -7.778208978395757 | -7.8428142088983686 | -7.465463746368536 | -7.880105631725595 | -7.903598469429503 | -8.053051440710124 | -7.809539588250451 | -8.073015424642973 | ||||||||||
| 289.036 | Sedoheptulose 7-phosphate [-H(+)] | cpd:C05382 | -8.38285977442549 | -8.428527720626255 | -8.527760435532766 | -8.402352672880557 | -8.26214409717304 | -8.555702957422566 | -8.20421798879021 | -8.31323894226206 | -8.427216736314294 | -8.177755064371484 | -9.712952308600716 | -8.351646766147159 | -9.794101451493908 | -10.037858247665461 | -9.867851815566274 | -10.003594017720477 | -9.74206706548208 | -9.72528311939227 | -9.861888922717704 | -10.210230961798851 | -10.09457592114911 | -10.226576677340777 | -9.83390355774001 | -10.27528931311324 | -10.186778851207436 | -10.188123103492536 | -10.094534518618168 | -8.770050972846738 | -8.651357408704305 | -8.653733360234199 | -8.872399062910148 | -8.63292875610601 | -8.871363259754286 | -8.531667943729 | -8.654441079158577 | -8.549749200848236 | -8.549614002748445 | -8.643238902832856 | -8.648823991750845 | -8.584657547032585 | -8.556387054766706 | -8.83688208161323 | -8.233251114044869 | -8.40222621287388 | -8.896098834254445 | -8.446033344336747 | -8.736501437415876 | -8.770209551158272 | -8.56024319357195 | -8.754060451032684 | -8.308273859454752 | -8.40259692127615 | -8.33033540247269 | -9.54484399351828 | -9.581811494560906 | -9.349271665910136 | -9.340233193488078 | -9.489338626345843 | -9.77710330185222 | -10.118973920851717 | -10.592375629553954 | -10.266852909124957 | -9.983201035345871 | -10.195181423116418 | -9.62683790569602 | -10.553401623672036 | -10.329046899762076 | -10.295934175074917 | -9.987357257874592 | -9.766811809062196 | -9.6899797914848 | -9.267328051385581 | -9.436304735330808 | -9.768190158165186 | -9.693854387241922 | -9.127635630584262 | -9.765338414930735 | -9.716642121876706 | -9.4359479303745 | -9.572506354320993 | -9.288850486240182 | -9.703694032275695 | -9.553348924850283 | -9.681406664278343 | -9.600989673793213 | -9.701619060420812 | -9.798535753387611 | -9.561946354505094 | -9.69086865519726 | -9.550602586468388 | -9.376939736827653 | -9.495102200889916 | -9.06259148987408 | -9.257354361886517 | -9.643911673457948 | -9.732599558281477 | -9.776519072357456 | -9.569602615515977 | -9.709762097966701 | -9.602370760841238 | -9.444192816720731 | -9.492383720139813 | -9.567549409321204 | -9.45232688180879 | -9.33398320490232 | -9.511153923296371 | -9.38368346926978 | -9.545501043682307 | -9.255156495248954 | -9.673814943978085 | -9.308385882606025 | -9.646770828404552 | -9.302590102866954 | -8.856540338783073 | -9.805630582081301 | -9.747630298928303 | -9.70165154257217 | -9.94911043623876 | -8.729201511234313 | -9.588003175484944 | -9.669823495357367 | -9.580174212607591 | -9.727138112926095 | -8.985925773957796 | -9.597530709270803 | -9.603330337081829 | -9.323292037137124 | -9.364657280547416 | -9.417669728129813 | ||||||||||||
| 306.049 | dCMP [-H(+)] | cpd:C00239 | -9.034998347594708 | -9.121510596091724 | -8.737321447697045 | -9.453325901891018 | -9.466998975576097 | -9.163259744187702 | -8.662890622997036 | -8.846814775407267 | -9.575794659418849 | -9.310230357515527 | -9.427199285638514 | -9.159332809641043 | -8.337498114960889 | -8.957093362167917 | -8.356419265589743 | -8.451039708245812 | -9.003073993467511 | -9.339842543044151 | -8.82276616231628 | -9.073177745461816 | -9.430739904018292 | -8.734097867140852 | -8.728294361340444 | -8.251404519285032 | -8.478837738742769 | -8.415280736277014 | -7.9552498228451185 | -8.817986170597687 | -8.76446640841175 | -8.82195122578947 | -8.907655455634082 | -8.945647658461947 | -8.78098754478836 | -8.832413157982172 | -8.869694984834316 | -8.965208892489255 | -8.684783565102295 | -8.233454860432287 | -8.814315781231903 | -8.69482060433344 | -8.918101949609069 | -8.438437139442854 | -8.586586229235749 | -8.477908618712153 | -8.606759537218265 | -8.633253881013458 | -8.805856143703762 | -8.742272254384758 | -8.266233910333113 | -8.906116695883213 | -8.80838866835518 | -9.073276365914397 | -8.75286370898437 | -9.34207292646078 | -9.092428539374998 | -9.448584931384687 | -9.295662921599968 | -9.419322564140852 | -9.095720310109266 | -9.397823232544106 | -9.364955645720208 | -9.389181061778219 | -9.353115511440006 | -9.640533997993035 | -9.264517280356827 | -9.799903954042204 | -9.562150299210433 | -9.58555633263791 | -9.55871389401031 | -9.265187438881306 | -9.187689346276288 | -8.935518150009509 | -9.13316941660378 | -9.202215627380546 | -9.30936084821359 | -8.63379849681618 | -9.196204233553857 | -9.362024048840933 | -8.949404273873203 | -9.235579407506183 | -9.156581041891297 | -9.410947922995419 | -9.293085398528287 | -9.42957601489439 | -9.399697644515246 | -9.316993543871808 | -9.492089754117854 | -9.481719878419721 | -9.068927074746291 | -9.256753327046853 | -9.129291824424913 | -8.914524875648215 | -8.980989934973044 | -9.208313440630604 | -9.261710601796906 | -9.15111820262156 | -9.441591669635502 | -9.253576516229767 | -9.126181818729208 | -8.93486229073874 | -8.674448176040023 | -8.639780526132379 | -8.895475123506946 | -8.625472808361415 | -8.61150614540894 | -8.548264081355018 | -9.083944909817607 | -9.060301303104799 | -8.447373354650791 | -8.800443863180655 | -8.766364062143614 | -9.190666944610154 | -8.921794759890108 | -8.498286756654684 | -9.311176253670746 | -9.02557535244289 | -9.159959655598648 | -9.217065134263938 | -8.82658818408145 | -9.035391704557439 | -8.962425844937284 | -8.762835623394668 | -8.674929130572899 | -8.39238862992004 | -8.951319797654886 | -8.920968393338146 | -8.775170764019107 | -9.183963104071236 | -8.89019058840447 | ||||||||||||
| 307.032 | dUMP [-H(+)] | cpd:C00365 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.618073373218113 | -9.591751614226938 | -9.996676576593945 | -10.033526006149849 | -9.708488733782819 | -9.348528607529223 | -9.50536094807926 | -9.634392260252525 | -9.82480463096102 | -9.644126637716406 | -9.559335829097176 | -9.657622756232794 | -9.93139781196013 | -9.783838031151488 | -9.60522808295337 | -8.75181751577153 | -8.741556011002633 | -8.761362474879402 | -8.771721065296985 | -8.57950031277343 | -8.697306882518085 | -8.438907877985246 | -8.61807585615616 | -8.674602637028118 | -8.504005360502417 | -8.608682414996998 | -8.57370242620658 | -8.592053306157355 | -8.793887775844423 | -8.506933889975027 | -8.383259468972975 | -8.4364542018549 | -8.603730201695804 | -8.27444746851848 | -8.553953106945817 | -8.54029447056095 | -8.536328070296259 | -8.612617026668111 | -8.65239163669479 | -8.342382636043158 | -8.679083323231204 | -8.752917430043665 | -8.434090005112912 | -8.859675688887982 | -9.191961978220727 | -9.02407477741495 | -9.46026610702551 | -8.992176544198214 | -9.349964839641872 | -9.299437091705759 | -8.960198672100804 | -9.68651527067094 | -9.3253422100735 | -9.5387440632853 | -9.32278407721632 | -9.738603810955448 | -8.041473227715873 | -7.423182287331663 | -7.496635967452503 | -8.998787770921897 | -9.129882931152666 | -9.195347628178098 | -9.286634760820032 | -9.224282365069595 | -8.951102428211545 | -9.217989532118882 | -8.945546362656286 | -8.97844914391376 | -8.975230069333579 | -9.216402150220057 | -9.236126787958305 | -9.192152029357706 | -9.35974185499305 | -9.192734762033638 | -9.534480701506885 | -9.374619773260063 | -7.930258536412006 | -8.767805543476493 | -7.766249915477394 | -8.519598898860883 | -8.832187386552855 | -9.07290067935396 | -9.042202328966903 | -8.042990602928302 | -7.794038941000071 | -8.219982971290936 | -7.7274982956863925 | -7.6923873667110385 | -8.774390178949957 | -8.54451745062071 | -7.576276519897834 | -8.48654104761381 | -8.71405698964097 | -8.366947361970878 | -7.4024441014337 | -7.675208358135929 | -8.253780040580471 | -8.284125695255574 | -8.999921173618436 | -8.45841073355485 | -8.305155813684282 | -8.37399616989906 | -8.192088448882366 | -8.505900547812054 | -8.771642593136638 | -7.662229152502491 | -8.33114983981137 | -9.015780167927996 | -8.511513771526264 | -8.867198916483991 | -8.231126646357179 | -8.476694598189283 | -8.358097545509128 | -8.08219494623221 | -8.199147098391578 | -7.741684923014513 | -8.224809237708591 | ||||||||||||
| 309.043 | Sedoheptulose 7-phosphate [+F(-)] | cpd:C05382 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -6.912593369067868 | -6.78423136671788 | -6.768921725224619 | -7.184946982919972 | -6.727489764214795 | -6.895253997349074 | -6.428123079025478 | -6.6117655327951015 | -6.5306039092962305 | -6.792915180978859 | -6.942258521065217 | -6.668284543474811 | -6.571968830060924 | -6.800219656086563 | -6.906797940178809 | -6.699695640551771 | -6.79444644466256 | -6.858484173008883 | -6.3360396407573125 | -6.844500470356558 | -6.78055888462203 | -6.837925402638715 | -6.927434836143734 | -6.878529914888365 | -6.121472061636886 | -6.893504426403577 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 321.051 | dTMP [-H(+)] | cpd:C00364 | -6.277968091740043 | -6.374918826071962 | -6.3468904459046165 | -6.650272406406561 | -6.557066717998743 | -6.483444312327314 | -6.261816610642132 | -6.292908404513647 | -6.801898700166199 | -6.639709826160861 | -6.9347298887685005 | -6.904823930360434 | -6.319865034749287 | -6.562755543846864 | -6.601064853056282 | -6.43831298609326 | -6.507601413197705 | -6.427352415343862 | -6.385832689977793 | -6.529246173232664 | -6.6292277222753215 | -6.2670739575287335 | -6.053529947035664 | -6.179061928123362 | -6.322674511712512 | -6.1352823579064735 | -6.18831232678283 | -6.545502595251084 | -6.413902618367394 | -6.378815436786621 | -6.47962671267563 | -6.353404443441208 | -6.529959995131031 | -6.46689603122693 | -6.606593189140011 | -6.448550608220049 | -6.456462575916191 | -6.345313657071058 | -6.492586761832864 | -6.197501974258947 | -6.443100512855558 | -6.456622181540982 | -6.2703048016891305 | -6.430593599973388 | -6.259440095895615 | -6.390816504389213 | -6.4348273221799674 | -6.30587817462363 | -6.27775300623919 | -6.471688449807604 | -6.478405725494388 | -6.245444163003912 | -6.494303928476912 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -6.517512598303181 | -6.747744816667875 | -6.761796605374524 | -6.483273512575121 | -6.327348989791653 | -6.354154684442885 | -6.297468312033336 | -6.4888932003442275 | -6.319589272807484 | -6.653780430252276 | -6.827735224808466 | -6.675437072007099 | -6.6206715639479965 | -6.425598523244209 | -6.4992103745583405 | -6.317803644810591 | -6.354166691565825 | -6.475559784141951 | -6.19306043128324 | -6.345957756589842 | -6.605839129658795 | -6.365191276381857 | -6.62906193002129 | -6.545150958711864 | -6.494467199717722 | -6.127651906793894 | -6.516844265981832 | -6.411577892015175 | -6.430629978581962 | -6.383464209400854 | -6.779933313890155 | -6.340738214421731 | -6.601286043881533 | -6.425110501663685 | -6.40182271495008 | -6.207378908529972 | -6.343416223862983 | -6.44556068430732 | -5.820860262909526 | -5.774721095333363 | -5.658185379548465 | ||||||||||||
| 322.045 | CMP [-H(+)] | cpd:C00055 | -5.806997100832318 | -5.310464160363148 | -4.546522690925105 | -5.750807150317849 | -5.794300911336759 | -5.646909338104841 | -5.027268400800298 | -5.348710190925127 | -5.890102885317764 | -5.629281762229443 | -5.769315205810242 | -5.591701912035777 | -4.502571173067777 | -4.8715405334177015 | -4.293994504131561 | -4.78227688306188 | -5.393906072736143 | -5.387893064651896 | -3.4328241762094533 | -4.28663021410213 | -4.815097680300635 | -3.364943257973668 | -5.265756982417748 | -4.992334293024865 | -5.4958543201714045 | -5.406030152050058 | -4.790587875203024 | -5.902979205122668 | -5.866169280400704 | -5.711499967441004 | -5.545847347275107 | -5.92534879042888 | -5.697342092178456 | -5.8804094565923 | -6.089185344335807 | -6.167213697660986 | -5.684820738678746 | -5.329683467496551 | -5.79953710790059 | -5.671727726385551 | -5.531257624593816 | -5.897796554851451 | -5.917010434014212 | -5.88614782914636 | -5.571959340979151 | -6.123285971509902 | -5.830217264443131 | -5.7236501190184175 | -5.6361478336763575 | -5.643227394094013 | -5.767657200828474 | -6.023503353566266 | -5.6872497701784495 | -5.757658467186786 | -5.676157579130716 | -5.681009265135276 | -5.558443485902469 | -5.647844413410724 | -5.509182344119215 | -5.841465320061794 | -5.867770524944352 | -5.81917560055424 | -5.888696646335489 | -6.0605105398490995 | -5.996118522366821 | -6.194851890906726 | -5.901096467633545 | -5.838351604093566 | -6.21453393280431 | -5.962945677333592 | -6.013687444256549 | -5.679237788337768 | -5.645507373784688 | -5.606359449164978 | -5.802222556266868 | -5.433638808244585 | -5.874630601169111 | -5.694176349594914 | -5.871508683562736 | -5.736050834257231 | -5.7517229435958654 | -5.792434223197544 | -5.562625069208227 | -5.6891053474452296 | -5.759348232331181 | -5.689493232326247 | -5.697734136591467 | -5.782150414656029 | -5.792344837903305 | -5.947507210174806 | -5.838785264541347 | -5.943895405186798 | -5.791302828274246 | -5.969360891714128 | -6.03745809891296 | -6.006948920173304 | -6.032953273722317 | -5.895986604871728 | -6.090406989166809 | -6.025916072639775 | -6.090249092126025 | -5.955491975646056 | -5.9301409810298695 | -5.8984986338384875 | -5.893974013725999 | -5.891791701154514 | -5.57248513525586 | -5.785921275469139 | -5.768994097616879 | -6.086499849699592 | -5.845476002355557 | -6.11175007258719 | -5.727578596996085 | -5.619248466429035 | -6.007592484636332 | -5.786435290888484 | -5.823465141327584 | -5.700203911241093 | -6.265147255241488 | -5.826634007517585 | -5.986316557209486 | -5.987091133458727 | -5.872126282263862 | -5.7876832127863 | -5.696905987275897 | -5.711804614578501 | -7.063476600972052 | -6.544499268361531 | -6.7256349708909235 | ||||||||||||
| 323.029 | UMP [-H(+)] | cpd:C00105 | -4.980214711576768 | -4.326826521189427 | -3.5203525555641506 | -5.158012893205588 | -5.1935519489174835 | -4.925004558894267 | -4.606014008358153 | -4.710946765634549 | -5.369608506962376 | -5.060949351270692 | -4.959377168899656 | -4.912554414737966 | -4.281824353676315 | -4.5884197225337 | -4.680134919237685 | -4.66794338423191 | -4.583135064960782 | -4.741536065603202 | -4.511166354956342 | -4.567942577499498 | -4.784856231073827 | -4.722669912584632 | -4.364081596237974 | -3.9838841818597266 | -4.414523822140659 | -4.375345217275766 | -4.065546024017775 | -5.141392372205908 | -5.084038482733991 | -5.036549657453432 | -4.8939874834604655 | -5.289616668997408 | -4.908042665844831 | -5.139871237879742 | -5.403223558450713 | -5.483538812169673 | -4.987047813550541 | -4.577466480882196 | -5.150140844132577 | -5.113618690456726 | -5.073374523926291 | -4.988878164738388 | -5.203040461427009 | -4.990076199963531 | -4.956832343988246 | -5.316298861277366 | -5.023691178096515 | -4.942175400960545 | -4.808926895703324 | -4.965221946269374 | -5.036920445555984 | -5.378014002743423 | -5.047161245499578 | -4.923928867374704 | -4.734723698510275 | -4.81926197559566 | -4.67187220108694 | -4.78013038308795 | -4.632885501938163 | -5.049308187853362 | -5.00688068956328 | -4.980494277832383 | -5.136424624305836 | -5.275563753402762 | -5.230058887081432 | -5.342095686489624 | -4.942732083102643 | -4.881615229601336 | -5.527829142292579 | -5.171681794793774 | -5.11567740362415 | -4.799165941040033 | -4.749894150507235 | -4.835588632593722 | -4.969159020161659 | -4.626986369993836 | -4.914329057123748 | -4.767540392952647 | -4.941357054933982 | -4.924793311361317 | -4.88960164301444 | -4.934498144527792 | -4.6104169344886134 | -4.742713241997489 | -4.792580571486243 | -4.7445472412496015 | -4.8709687391576235 | -4.877659161022377 | -5.0919177636172686 | -5.161906964964864 | -5.1078260307394086 | -5.311079924337159 | -5.02540082052499 | -5.348686357961208 | -5.294755922983569 | -5.19280559693037 | -5.24666272926041 | -5.106782089208516 | -5.290141775965291 | -5.233711953177059 | -5.323820246974762 | -5.1227409336490455 | -5.240783674916742 | -5.01329665461523 | -5.135771523947246 | -5.009193629021518 | -4.79964135004429 | -5.078992007119035 | -4.992267279965473 | -5.341959364960462 | -5.085601955629668 | -5.382199391744241 | -5.090261970000386 | -4.8743236996553625 | -5.284068993502476 | -5.164822655582496 | -5.18692962174614 | -5.0402582501654605 | -5.542268992908957 | -5.184238216265594 | -5.295149022286291 | -5.291989833334846 | -5.199929755317822 | -5.107917205424207 | -5.037003182061271 | -5.019151585863199 | -6.387522670974381 | -5.914226621553859 | -6.00302352142792 | ||||||||||||
| 326.059 | dCMP [+F(-)] | cpd:C00239 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.165162005453627 | -9.36552400623016 | -9.017110255629733 | -9.203177521794542 | -9.27217625287084 | -9.204297791619622 | -9.131678870168319 | -9.098864772148177 | -9.448392170911017 | -9.205867542568237 | -9.027955150248266 | -8.862402362871228 | -8.876945326302279 | -8.904459379415062 | -8.982976577395343 | -8.919205924063252 | -8.81595193502532 | -8.948509549338787 | -9.11250312241341 | -9.199848032626344 | -8.95581335082918 | -8.918611787068185 | -8.950088585704785 | -9.06752107977873 | -9.00898466616187 | -8.835821138940412 | -9.34751840677054 | -9.401021351191135 | -9.444048974902032 | -9.501713192199853 | -8.753195185739855 | -9.09368167999746 | -9.158044874536792 | -9.269787370091143 | -9.01725778252446 | -9.02132719528084 | -9.332492596345164 | -9.213452976964057 | -8.87899021469782 | -9.08619322483451 | -9.068055479597472 | ||||||||||||
| 327.04 | dUMP [+F(-)] | cpd:C00365 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -10.15830916016827 | -9.922517204400455 | -10.338849877234045 | -10.280326383208955 | -10.275331330478364 | -10.963401074418528 | -10.400673462576387 | -10.908969285750835 | -10.780745987755505 | -6.37457282316791 | -9.634545582826846 | -10.421632630325199 | -10.820755738643108 | -11.05775752940193 | -11.323404627871529 | -4.175451339124124 | -2.9277942757071638 | -3.166126215365041 | -10.185489544045367 | -10.17461055359759 | -10.369065593073172 | -10.559289214285208 | -9.715704965313977 | -10.509567233835748 | -10.866969300132107 | -10.04830448328854 | -10.254356118126408 | -10.007255477877289 | -10.67917011141574 | -10.338284967012694 | -10.432236849046495 | -10.423324081415316 | -10.730016130050974 | -10.730205235848432 | -10.254952177122526 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 330.062 | dAMP [-H(+)] | cpd:C00360 | -8.406318777486888 | -7.728237457483096 | -7.358039031209062 | -9.398133849884267 | -9.583617159726142 | -9.321830847014882 | -7.448580174095719 | -8.919255393498227 | -9.259710399278246 | -8.65110331250098 | -8.3154182994751 | -8.860868488764442 | -7.585858996007584 | -8.342308294536627 | -7.709917716535751 | -7.828488240929169 | -8.408098484115273 | -7.932191739748389 | -7.118295317462668 | -7.87878252532277 | -8.565439051323244 | -7.180138212719727 | -7.443094219565006 | -7.195395922502583 | -7.905707340295418 | -7.516470205358717 | -7.152092740143949 | -8.932559690840954 | -8.65437388188493 | -8.884398977292328 | -9.052246340014575 | -8.860847852663094 | -8.945521113985514 | -8.639031462779606 | -8.983620286746127 | -8.826492007932673 | -8.442951994404147 | -7.869304508974177 | -8.867553709796457 | -8.893487914348857 | -9.014381875640927 | -8.333260773938317 | -8.53331295649336 | -8.468871842118274 | -8.76066920556979 | -8.554758600660554 | -8.775530893089343 | -8.591420448086462 | -8.101886986687559 | -8.93788105470169 | -8.841106931246324 | -8.886986554360114 | -8.778973938484887 | -8.840876756838671 | -9.199434608501036 | -9.197502754692831 | -9.046215190491973 | -9.190899137561349 | -9.030617528743822 | -8.695230329985076 | -8.222232847247996 | -8.573347863571927 | -9.205609059400269 | -9.471662836391232 | -9.091156183152881 | -9.550235637793287 | -9.336947166187748 | -9.207300021436481 | -9.589297204397608 | -9.199375349095346 | -8.97303287722683 | -8.785036223152455 | -8.719227603241002 | -9.176358669533416 | -8.822929286219983 | -7.918959110825793 | -8.831132792112857 | -8.87959450585316 | -8.369254655318231 | -9.308652597332358 | -8.690713099772369 | -9.369329293916593 | -9.009039020313196 | -9.042449860623533 | -8.931303464706408 | -9.406695074069736 | -9.502193753704475 | -9.327362197649306 | -9.633617170993594 | -9.67977495877834 | -9.578330125008556 | -8.627023618621541 | -8.509521795244792 | -8.997949275726567 | -9.030558229159556 | -8.924247736146944 | -9.195338346577373 | -9.419255015215684 | -9.152228820191938 | -8.908257520518628 | -8.707664747079189 | -8.629075103520545 | -8.787000132630338 | -8.41812252330862 | -8.233728052536907 | -8.225248919661357 | -8.875845741086183 | -8.996155706816094 | -8.037945043756071 | -8.919108868290866 | -8.556853994906815 | -8.996784333390421 | -8.908109260483345 | -7.947760188171731 | -9.41484410702081 | -8.773543441389387 | -8.71620368252816 | -8.977381947259746 | -8.887327525616593 | -9.28793486582606 | -9.270003545626375 | -8.758549019850271 | -8.569428112339804 | -7.998290838078523 | -8.522283148546034 | -8.90681072743445 | -9.257830668870083 | -8.989858776909305 | -8.763190770597188 | ||||||||||||
| 335.043 | Nicotinate D-ribonucleotide [-H(+)] | cpd:C01185 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.554260615023084 | -8.88024822918004 | -7.772689339572325 | -8.172326637782959 | -8.779678091596889 | -7.521976415384066 | -6.570189454489468 | -8.551948370259206 | -8.558299424790636 | -7.527893951630018 | -8.64051613195255 | -8.535392193578357 | -8.926569282239226 | -8.804001821764231 | -8.146201125858015 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.916695007697749 | -8.587678233839084 | -9.041222862557014 | -8.69597189285905 | -8.615474547761318 | -8.890548833528667 | -9.106416168508439 | -9.237743666558579 | -9.451265406294208 | -8.392149036236194 | -9.123365370679565 | -9.117906251421132 | -9.565764023683725 | -9.22963870581283 | -9.406535749560046 | -8.019391178341602 | -7.4673049728971845 | -7.346334966679758 | -8.64005284107267 | -8.393657606021852 | -8.711317934091195 | -8.789947012378185 | -8.450405227961939 | -8.914357923343367 | -8.749717564672695 | -8.744589796884584 | -8.776267879447532 | -8.761971837506104 | -9.125351945755384 | -8.715040390771746 | -8.67898287455542 | -8.669951553147815 | -8.823734278547509 | -8.810851476351012 | -8.839896372531504 | -9.001366712765826 | -8.871394087418304 | -8.645925671611373 | -8.597665616777288 | -8.438109865754031 | -8.628564227366343 | -8.93512604903708 | -9.046147041678786 | -8.953937819818806 | -8.762802881292135 | -9.097129071907494 | -8.703898854542455 | -8.556895632468013 | -8.72247268998336 | -8.803054522500506 | -8.919672949385035 | -8.430238046820644 | -8.677646534390338 | -8.298630881743488 | -8.82438175762034 | -8.472874857647296 | -8.735094262654895 | -8.30306646351893 | -8.826799022337717 | -8.591466920281418 | -7.866047762736175 | -9.000892719376242 | -8.975078903581604 | -8.820893317197374 | -8.958095256731493 | -7.079979254481944 | -8.604725463812 | -8.71683721751215 | -8.72579753807983 | -8.696943116692838 | -7.863042889849566 | -8.651261796675678 | -8.953314765637545 | -8.71962426118806 | -8.214236603570637 | -8.263218435309547 | ||||||||||||
| 338.99 | D-Fructose 1,6-bisphosphate [-H(+)] | cpd:C00354 | beta-D-Fructose 1,6-bisphosphate [-H(+)] | cpd:C05378 | -6.644356666451491 | -7.846219790892848 | -8.926616609112019 | -7.945823321467288 | -8.069722898548827 | -8.051096400620208 | -8.849997143976431 | -7.922618673902851 | -7.756819829371014 | -8.699838000586578 | -9.220504535469212 | -9.347382647378959 | -5.706731187656459 | -6.01861726826618 | -4.903062317211702 | -6.642775688841323 | -6.8526600520501635 | -6.430896276963047 | -3.781335703730658 | -5.758727388571899 | -6.508393561668346 | -4.557891863925896 | -7.216018575034756 | -6.5820877631625665 | -8.276042392869009 | -7.21971210313101 | -6.07148091734281 | -7.7861621945330395 | -7.540275274919973 | -7.378115767427033 | -8.486387686100757 | -7.560822042738827 | -7.147057012894012 | -7.382968872844023 | -7.43644273373073 | -8.188060372261763 | -7.889416784099849 | -7.894302820935361 | -7.746520975958402 | -7.2350012901998495 | -7.615030644941854 | -7.54343336432659 | -7.278524009220365 | -7.2675754233208085 | -8.033308873310503 | -7.753187348928059 | -7.817496006296906 | -7.664342945287951 | -7.36356995521303 | -8.195348942593883 | -6.190846711006909 | -7.151311123265153 | -6.527243851172475 | -8.819361186390227 | -9.064836779488074 | -9.225616251695788 | -8.731536601669433 | -8.737321864479457 | -9.330216396167996 | -8.721902607474135 | -8.581667786597086 | -8.382904783087683 | -8.526282955722658 | -9.194111149121897 | -8.93063452756384 | -10.211088776207637 | -9.425649381020772 | -8.969866828797407 | -8.552748259537168 | -8.124253416473605 | -8.12813407073933 | -8.981418615474077 | -8.935091665968146 | -9.529506512128606 | -9.0662079097038 | -8.140799635900136 | -8.993729155085052 | -9.130941190057214 | -8.643774364950634 | -9.539636984867498 | -9.238619060934916 | -9.554510475103429 | -8.947259859231348 | -9.012715478817418 | -8.79987058150297 | -9.386857207085797 | -9.301420433180292 | -9.096999226960792 | -9.401682542442144 | -9.736577550328676 | -9.470779964597977 | -8.124694637084723 | -7.337889223891707 | -8.076932927660536 | -8.276016353150954 | -8.464072021908255 | -8.761372507637724 | -8.312700862559927 | -8.583955131488002 | -8.358641928849476 | -8.086051117043098 | -8.212088731986313 | -8.10216753426362 | -8.422083017670097 | -8.29435523468092 | -8.476919344589009 | -7.204690680216677 | -8.134063766181075 | -8.020036364804362 | -8.738813923384512 | -8.528445760791465 | -9.25553858026233 | -8.20485095045375 | -7.707091138402401 | -8.960054128746727 | -8.79703275632516 | -8.845215454107649 | -9.001827428538256 | -7.246584639726616 | -8.011994045178849 | -8.665725455329968 | -8.860594337900766 | -8.947684657847857 | -7.9365811302824945 | -8.503859795175968 | -9.194234341044604 | -8.381167047571585 | -8.515995771008352 | -8.524188912946986 | ||||||||||
| 341.056 | dTMP [+F(-)] | cpd:C00364 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -6.487398155721357 | -6.419823561584882 | -6.811288963304064 | -6.683776863966559 | -6.099738946052598 | -6.115005434333899 | -7.080930196783994 | -6.664691674744916 | -6.723262115183288 | -7.488693967530224 | -6.10912195354302 | -6.664415360413266 | -6.218495041929537 | -6.38153607621239 | -6.8265994733581445 | -6.716974295585384 | -6.603648374326336 | -6.610795065065152 | -6.1150526576332815 | -6.3801736515325445 | -6.512709324708549 | -6.400623728738075 | -6.49749985143044 | -6.842842423069494 | -6.864648170660025 | -6.851443873955617 | -6.468357149134344 | -6.4446775141904356 | -6.561094239509551 | -6.271829461434154 | -6.326500163922654 | -6.39602435936314 | -6.437087284092107 | -6.218917206046823 | -6.490325706476306 | -6.577510440646638 | -6.630334643042733 | -6.694955354033363 | -6.521394599378888 | -6.608096616478477 | -6.760439295898581 | -5.92386662295871 | -5.853034035417132 | -6.8738054106477735 | -6.4990169078229725 | -6.092266939446838 | -7.138190402613522 | -6.414717314993528 | -6.641454887065627 | -6.64961944301631 | -7.071676103122602 | -7.503634323087255 | -6.816956857711819 | -7.352023820419643 | -6.866187933648099 | -7.641633468526238 | -8.026878417304601 | -8.357521408594865 | -8.264124989834626 | -5.666747119016032 | -5.670836041966688 | -5.7905440106703345 | -6.167300524740729 | -5.556045895519141 | -6.258296060751515 | -6.4983558282200145 | -5.928683620678668 | -5.9990782395067646 | -5.6171140429932995 | -7.05387182692369 | -6.172931083305953 | -6.298429691069305 | -6.169690297857126 | -6.533719658408667 | -6.4195018075028605 | -6.306388096692757 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 342.05 | CMP [+F(-)] | cpd:C00055 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.751695066454033 | -9.052681266665306 | -9.057119882076442 | -9.01618463608245 | -9.037694113263747 | -9.326016966745275 | -8.793009846634233 | -8.619952610119872 | -8.848188694286288 | -9.319194555455557 | -9.32552172422742 | -9.028307736481281 | -9.561557902982488 | -9.351710362227442 | -9.414051556973817 | -10.097607869310714 | -10.422851440193465 | -10.179944415948501 | -8.621798724816491 | -8.739490840286509 | -8.856230202472513 | -8.592496003404328 | -8.57596449330179 | -8.943307559632983 | -9.132774886920524 | -8.652984315797264 | -8.762846209426785 | -8.656054877669261 | -9.306774422463825 | -9.027984107867773 | -8.935593499840115 | -8.777736919545625 | -9.028216842279724 | -8.903732340605583 | -8.814715283124771 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 344.076 | Thiamin monophosphate [-H(+)] | cpd:C01081 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -10.117249860933383 | -10.509923968652103 | -9.500652830398122 | -9.303799125844687 | -10.49002037069509 | -10.53369452039258 | -9.812616351675217 | -10.356182395560715 | -8.623942446928345 | -9.541453167626976 | -9.979201917829213 | -10.09882989918899 | -10.411248712113895 | -10.429793025311199 | -10.087998662234433 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.351801745182785 | -7.959202472091837 | -8.35683358744869 | -9.21298538694023 | -9.176953796727114 | -9.889332267902864 | -9.67352869476538 | -9.855667452364553 | -10.022598752789388 | -9.592664622174805 | -9.779688846103788 | -9.938691107615174 | -10.309366837012735 | -9.878448768576936 | -9.7113473127386 | -9.93032126096075 | -9.786094067112934 | -9.827372891555635 | -9.344140793469862 | -9.358587976127478 | -9.296770072564465 | -9.586919828213402 | -9.303058063302297 | -9.388172424920219 | -9.539517263493144 | -9.367864240751652 | -9.391527334012327 | -9.365644129293873 | -9.695820403446207 | -9.497874166593805 | -9.45945480835626 | -9.468559739963101 | -9.605785283346584 | -9.398503960491826 | -9.550432872793563 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 346.057 | AMP [-H(+)] | cpd:C00020 | dGMP [-H(+)] | cpd:C00362 | -4.611394371119761 | -3.0008028180547366 | -2.2036825552598382 | -5.017011522666922 | -5.137841766000148 | -5.014022972414933 | -3.1363635284901776 | -4.780531830734503 | -5.072390164829334 | -4.282465512342788 | -3.5411881580543536 | -4.303502090893508 | -1.6459663429485945 | -2.149637350273886 | -1.6251882067067627 | -1.7841950899095638 | -2.1617880816529835 | -1.971897432233921 | -0.9801212362535482 | -1.6742548365311025 | -1.447489183625694 | -1.0063860354465721 | -2.3762711266600474 | -2.201272983383191 | -2.7588373486867237 | -2.500695416408835 | -2.2184778107962626 | -5.15965274087796 | -4.751705119428529 | -5.070505248351589 | -5.404847199397835 | -4.941800336514671 | -5.014701831930084 | -5.132876257507707 | -5.57509776817406 | -5.7064731273551175 | -4.582926930178823 | -3.5830861179820137 | -5.491253483139636 | -5.154808497236307 | -5.3710228727682106 | -4.646099944679353 | -4.4991087152089895 | -4.289339196179857 | -4.8883131131400415 | -4.378589296613716 | -4.104233252509254 | -4.753625626912331 | -3.5757996771226797 | -4.8170269504420995 | -4.809585449715692 | -5.311177629786347 | -4.870129852727626 | -4.500401877958263 | -4.749758675625655 | -4.8098083844537145 | -4.961391302869471 | -5.131770616916286 | -5.1804693695925845 | -4.175980856664593 | -3.816634479220878 | -3.8849138350857455 | -5.105879597557672 | -5.3996028544614685 | -5.29449623234299 | -5.360977517493022 | -5.108426451156711 | -4.954713845979493 | -5.67242739616909 | -5.452369712642624 | -5.413449989147843 | -4.410018848204628 | -4.362436389656303 | -4.687789304320757 | -5.012817291275605 | -4.129330810637897 | -4.956183984188237 | -4.612641514616771 | -4.596678832197093 | -4.929099868444298 | -4.871718116611073 | -5.179643811597792 | -3.9655509802760522 | -4.842194652108753 | -4.819211371681008 | -5.1787514630656695 | -5.1650570419648405 | -5.051387939249848 | -5.378431328318556 | -5.510056357626924 | -5.415605921613111 | -4.83543212702128 | -4.749155413789321 | -5.138570321768589 | -4.588190543450534 | -4.687328886185323 | -4.883825810440512 | -4.765566915475732 | -4.859789220645197 | -4.322982096025785 | -4.753642987354825 | -4.356589376459881 | -4.730027386931107 | -4.396568558612395 | -4.292095615251149 | -4.38059955804976 | -4.525244560692741 | -4.610486770526314 | -4.014282453302233 | -4.563460516979303 | -4.466502450211402 | -5.062389917312966 | -4.706942406199251 | -3.6668296490423455 | -5.045078309875884 | -4.144628355330573 | -4.462060791723713 | -4.693759711914954 | -5.220244771686828 | -4.8289115949635875 | -4.847831318622001 | -4.816344427410256 | -4.659234948698771 | -4.186852106090593 | -4.497512371745942 | -4.81289873204282 | -5.66175774059646 | -5.458253040600842 | -5.158781451161577 | ||||||||||
| 355.046 | Nicotinate D-ribonucleotide [+F(-)] | cpd:C01185 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -5.771729079347073 | -5.79533414912148 | -6.238984577504253 | -5.828206578811857 | -5.492056809271307 | -5.70459487959205 | -6.317742236712116 | -5.903320373836795 | -6.221642120297619 | -6.350954479687669 | -5.595872006402357 | -5.887137784717181 | -5.832086066485336 | -5.889709475606642 | -5.990704564832028 | -5.835583450494744 | -5.738045664925819 | -5.501620229615512 | -5.255641450555689 | -5.554750465289806 | -5.666390688424658 | -6.0666700332611825 | -5.849536573589513 | -6.095784147593426 | -5.691084127139271 | -5.774122142279835 | -5.663355424482349 | -5.4578419941094625 | -5.354214220738559 | -5.702798011094634 | -5.381356228732727 | -5.504597696124196 | -5.400830442486453 | -5.961883865464939 | -5.510278533669444 | -5.427175734646654 | -5.374911094965585 | -5.334240751293451 | -5.582585361025915 | -5.769925431129363 | -5.3766666244178465 | -5.309189551306749 | -5.044173462316434 | -4.938646655343811 | -4.862665870677587 | -5.14904574214614 | -4.728492156871885 | -5.413620184349829 | -5.630661258654666 | -5.452297724667675 | -5.073730381001364 | -5.349928465056528 | -5.417185212386086 | -6.0995280182899965 | -5.1503463831511285 | -5.210615079185814 | -5.267315476385481 | -4.889215637849688 | -4.759355167117716 | -5.133775317170819 | -5.192509752865081 | -5.029720026663335 | -5.1403018304192925 | -5.537106548094499 | -5.16159116886195 | -4.9929479126986624 | -5.513609430511391 | -4.975020153750979 | -5.23160036324573 | -4.809062119479066 | -4.942852222992206 | -4.887411253466768 | -5.021279442632053 | -4.957603861750276 | -5.095589277536724 | -5.162415220216878 | -5.81647307303335 | -5.860155618264618 | -5.704074919654062 | -5.786532725663731 | -5.799233673727107 | -5.64286692240697 | -5.874463319280179 | -5.754259558415225 | -5.766461455528059 | -5.734575086582202 | -5.805351947014015 | -5.745561692225617 | -5.7619287075660335 | -5.851660768611924 | -5.726975792124521 | -5.814409633762719 | -5.867656298924721 | -5.881923266948953 | -5.337700936031719 | -5.625396292331045 | -5.962245814178735 | -5.939599156521121 | -5.715178597201203 | -5.926716553131186 | -5.623574672119723 | -5.815669559289411 | -5.893016849343228 | -5.942068833258149 | -5.941585503685507 | -5.618100305465727 | -6.037059001536182 | -5.862287185939824 | -5.872226923803319 | -5.910483702767574 | -5.8547015740372395 | -5.820954331733458 | -5.321207464250523 | -5.319446474285732 | -6.726795990037151 | -6.331007814866639 | -6.40906301933286 | ||||||||||||
| 357.089 | Pantetheine 4'-phosphate [-H(+)] | cpd:C01134 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.355940568641659 | -8.55507492895858 | -8.644606410369946 | -7.579399385599245 | -9.072607397723742 | -8.883206751251526 | -8.169924677891562 | -8.503297507579441 | -8.877917566700342 | -9.333397949715103 | -8.717704519394875 | -8.451292151455972 | -8.721328784016817 | -8.789573672215619 | -8.846122247757144 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.921950596664069 | -7.816579112875003 | -8.304341539087934 | -7.756693723871147 | -7.632803823322878 | -8.214554446396123 | -8.316126447999588 | -8.485204286669164 | -8.782897127150255 | -8.0615261230281 | -8.642228128005137 | -7.938645301800454 | -8.875142631434592 | -8.58675488918179 | -9.031745296679572 | -7.159483387807114 | -6.76521987882485 | -6.7164825379580195 | -6.889748307006674 | -6.92062314284109 | -7.105998220673406 | -7.515257470854181 | -6.647454662509114 | -7.714175036782174 | -7.799069998252704 | -7.516498288784363 | -7.459555213930095 | -7.129341291650303 | -7.899768504063983 | -7.577504394224801 | -7.505973706611487 | -7.414864935109795 | -7.8280739734057585 | -7.755233506880981 | -7.7837950168388295 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 362.052 | GMP [-H(+)] | cpd:C00144 | -5.682029308037845 | -4.995653288629441 | -4.290745348183018 | -5.263347954729344 | -5.352153823807447 | -4.9821262105915585 | -4.921659948773423 | -4.800071520481097 | -5.461821181085025 | -5.33790886612319 | -5.5706344422699265 | -5.237086880204154 | -4.797069166241304 | -5.075544763405445 | -5.1734662841961665 | -5.1319538841636225 | -5.002300359513447 | -5.2935244263398085 | -5.065929940983994 | -5.207987367817956 | -5.474425449519024 | -5.233046799778574 | -4.917824409809667 | -4.644942829906497 | -4.926531320877079 | -4.917090523213669 | -4.798087934982544 | -5.492121845943663 | -5.421189494064093 | -5.150086150448531 | -5.2116047367730225 | -5.334063937970772 | -5.374611015039581 | -5.523360250729643 | -5.510476541305532 | -5.830475952236795 | -5.254931913941997 | -4.8489696448373545 | -5.556719898553237 | -5.2113976078966555 | -5.201434461012397 | -5.362796118502996 | -5.2656436999029905 | -5.390601491085622 | -5.311976492199573 | -5.606499147856771 | -5.380076106544193 | -5.24546443229786 | -5.212316333991467 | -5.3493771662466845 | -5.134151467818873 | -5.49610588282067 | -5.136731430634596 | -5.380267856771144 | -5.176471659394187 | -5.251227226504799 | -5.132429545326609 | -5.208893413822422 | -5.036691569817613 | -5.480314591070592 | -5.608259755016907 | -5.5685116933615895 | -5.588506186844296 | -5.628190240374334 | -5.76773443201993 | -6.0174141631769755 | -5.57078751797884 | -5.380001562491198 | -5.989285730603006 | -5.674488119859753 | -5.646142297257538 | -5.206735416938776 | -5.285436854927297 | -5.228665319730515 | -5.303757274338287 | -4.941839108453279 | -5.323054453981611 | -5.2077996148639905 | -5.462030391937706 | -5.30060304823226 | -5.2063315091270805 | -5.2277339358048325 | -5.032131639936128 | -5.131562278020501 | -5.2838812185342 | -5.12732447336418 | -5.190766063833792 | -5.340760497471197 | -5.208755625926229 | -5.353492740246602 | -5.279228512661597 | -5.53360524875651 | -5.2708350089258715 | -5.504973699436467 | -5.315619494112697 | -5.229547165425016 | -5.263331395011868 | -5.0352112812582 | -5.310378199450756 | -5.2120818596645995 | -5.426908869101041 | -5.255824714915647 | -5.2245490218288 | -5.240523754325718 | -5.3554513682276985 | -5.255706788739661 | -4.866411098868191 | -5.1093536513126105 | -5.362758910614972 | -5.458268232020605 | -5.217021460526105 | -5.486559732010974 | -5.113046176581887 | -5.146299474076406 | -5.263024164169115 | -5.372840986582639 | -5.410424729749659 | -5.090526303838454 | -5.609695019392013 | -5.323554314337959 | -5.387550907888072 | -5.424795912933892 | -5.339764114311111 | -5.391877615930588 | -5.101328307991078 | -5.110706395591363 | -6.516230323087636 | -6.070502166570848 | -6.290338353884593 | ||||||||||||
| 364.077 | Thiamin monophosphate [+F(-)] | cpd:C01081 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.842708558793857 | -9.955043837076325 | -9.675048001662025 | -9.558194801416464 | -9.634371229393345 | -8.907355219869608 | -8.707618318858056 | -9.694761280304514 | -9.921652697733576 | -9.509178473519171 | -9.455087825327679 | -9.734628037359272 | -9.7979713417812 | -9.86419445894577 | -9.538672793766978 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.335131465937042 | -8.172310046198746 | -8.52237387441532 | -8.87744258811354 | -9.126922691708335 | -9.023309625146672 | -9.295657945998963 | -9.198946248795147 | -9.25110552603238 | -9.355170424982614 | -8.994935893490323 | -9.127717102864114 | -9.551327765848576 | -9.505041593427649 | -9.322424720715517 | -9.162267811225153 | -8.72613877240793 | -8.839680060955923 | -9.26229193277862 | -9.120635913787712 | -9.121277711036656 | -9.084054214695076 | -9.166157632650163 | -9.259497916956368 | -9.367798825790794 | -9.09160240227247 | -9.210963343457987 | -9.173949159519562 | -9.195224786339914 | -9.290720506770525 | -9.321023626868897 | -9.18023100500022 | -9.241705031632728 | -9.332998276738138 | -9.175024494134615 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 375.132 | Riboflavin [-H(+)] | cpd:C00255 | -7.037008572159696 | -6.793152263006424 | -7.04504751613417 | -6.768732985399665 | -6.8127537945838235 | -6.698219862241644 | -6.481080760546524 | -6.591615920777898 | -6.801566156320002 | -6.892642485411805 | -7.498348373099483 | -6.7979524478279005 | -6.453597226312492 | -6.448091372920618 | -6.86262497724726 | -6.616252935446303 | -6.403104034035154 | -6.746604148137375 | -7.199072368038999 | -6.766036803507844 | -6.886008851056957 | -7.052332461816731 | -6.185969191156552 | -6.260500277273635 | -6.504340294998467 | -6.46526877594012 | -6.5206409698298575 | -6.334647373707791 | -6.376167734675376 | -5.867114435843408 | -6.031783597038495 | -6.098287693236019 | -6.057890262543407 | -6.3976102087753075 | -6.150671578039024 | -6.672484484727549 | -6.081096604722101 | -6.225252474796157 | -6.134935032062132 | -6.116115713037202 | -5.830285584462723 | -5.986100966497437 | -5.8037288887834135 | -6.192174010640543 | -5.933774303710531 | -6.319902419101612 | -6.1642152777241055 | -6.003072480625213 | -6.000039732174871 | -5.895236364843921 | -5.876701815395668 | -6.410670411608387 | -5.741822789849066 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -6.460223535367361 | -6.831368441884615 | -6.232631273445402 | -5.829063418307983 | -5.732836998796931 | -5.919279636096196 | -6.150579961253563 | -6.4950948811046825 | -6.710141271357261 | -6.187534317958961 | -5.984880600687808 | -6.104877048086703 | -5.571261857069601 | -5.773685079475476 | -6.078951025947597 | -6.006277737583364 | -5.683871347121538 | -6.290098530728252 | -5.7499112587154775 | -6.0531706056899 | -5.578850735706789 | -5.441606888654537 | -5.2302387188680735 | -5.39753511911695 | -5.636822950877416 | -5.4470498941034124 | -6.480094460662714 | -6.382635402244006 | -6.503945569717213 | -6.722334549898246 | -4.247247410326085 | -6.03232281736702 | -6.122268503420392 | -6.272434958500433 | -6.169739296589921 | -5.573367512999554 | -6.004102238343772 | -6.062104013232065 | -7.217617720416522 | -6.459660991079372 | -6.9337974160797655 | ||||||||||||
| 382.058 | GMP [+F(-)] | cpd:C00144 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.151595897715872 | -8.610317898873777 | -7.914520211677039 | -8.464369427832052 | -9.27569933058608 | -9.19303657342091 | -8.319340698734534 | -8.46216496226065 | -9.100307712203529 | -8.26037887851144 | -7.879779896022115 | -7.602269621228852 | -7.335998408023449 | -7.401067708990239 | -8.061833097643463 | -7.501370799899737 | -7.399693263652466 | -7.735457561235821 | -9.016193403933748 | -8.607160189434394 | -7.347973699430716 | -7.291542770775824 | -7.753848476650218 | -8.097649376852912 | -7.986398282963794 | -8.017894321374921 | -9.00009994141555 | -8.664924416715758 | -8.578094974419129 | -9.084882503385625 | -7.769888253423687 | -7.982822377806616 | -8.278764756222536 | -8.014366772662466 | -8.096623083309785 | -8.221207994381333 | -9.059402883739697 | -8.848297213715362 | -7.704415450553864 | -8.499952276287818 | -7.918247444719796 | ||||||||||||
| 383.117 | S-Adenosyl-L-homocysteine [-H(+)] | cpd:C00021 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -6.864678502617801 | -6.785068248419306 | -6.855832906432233 | -6.8876753467018474 | -7.004123269127787 | -6.823548264476526 | -6.488461674795858 | -6.925131461370561 | -7.214952747914508 | -6.909348654903282 | -6.638099755759425 | -6.746434778217371 | -7.003024569580029 | -7.05390294258565 | -6.3201657595192975 | -6.2855511844634675 | -6.203183440803351 | -6.7992981921324755 | -6.584201185452538 | -6.642403196810044 | -6.592007967526662 | -6.453577137429456 | -6.729074253354952 | -6.651140713572224 | -7.289794911398332 | -6.821333679507621 | -7.763403690808896 | -7.1525151079121825 | -7.8530701079648795 | -7.319755806626446 | -7.13385158723884 | -7.967572436218223 | -8.04212839608878 | -8.162996577944801 | -8.25753853300732 | -7.72931597168279 | -8.293781308528688 | -7.9721142335999655 | -8.252156019300713 | -7.975529737337886 | -8.295930408368692 | -7.189515053082937 | -7.556638821196864 | -6.9368139513342415 | -6.915352746343468 | -6.788686701744079 | -7.20995661667491 | -7.659213672856043 | -6.820882091290451 | -7.6391106836208715 | -7.498944193052361 | -7.102154094102434 | -7.305549121456176 | -6.76646108946497 | -7.989469281500002 | -7.203611347076575 | -7.254648740334006 | -7.443430383852745 | -7.4782546313976725 | -7.474061962269754 | -7.468796940556724 | -6.263518054882159 | -6.807243169271696 | -5.745396337234252 | -5.921076381656209 | -5.150682964899446 | -5.853982551408186 | -6.241384282090689 | -6.333123670987281 | -7.058109123820515 | -6.3901235167278045 | -5.955169689335645 | -5.700137777628143 | -5.385271391894485 | -5.2491521506987135 | -6.192024956667624 | -5.579327251339916 | -5.1934263660873725 | -5.6702784264996025 | -5.97311152920545 | -6.649498529308865 | -5.1371230638510585 | -5.504978890525566 | -5.227583738281901 | -6.0770625012027075 | -5.780406368981787 | -4.832401121756617 | -7.127456500205314 | -6.754983289409093 | -6.748105445103439 | -7.040667367334399 | -3.565344931201165 | -6.01450276604154 | -6.106342082948205 | -6.0158673234450415 | -6.019544342656608 | -5.048922519482704 | -6.76977255838698 | -7.155057385703851 | -5.402571501738372 | -5.837117325651342 | -5.695864980773923 | ||||||||||||
| 386.016 | dCDP [-H(+)] | cpd:C00705 | -7.798810063454719 | -7.484443538605075 | -7.020342017015643 | -8.155383015812653 | -8.295344919817406 | -7.899081735144779 | -7.139425147921728 | -7.651867384931261 | -8.008391546364432 | -7.630036935372273 | -7.638062656951067 | -7.72020251145341 | -7.821180713561583 | -8.653331337138356 | -8.292180592266835 | -7.952570416159323 | -8.263704495271949 | -8.876163925990127 | -8.782218624705674 | -8.693978085533011 | -8.74437139983754 | -8.66332234607154 | -7.650414788713919 | -7.668567233193238 | -8.137991211210569 | -8.116521703932381 | -7.80705011538181 | -7.745565554964863 | -7.616411372700916 | -7.622563645700516 | -8.928544051603925 | -7.718096896733636 | -8.17899608099593 | -7.97208712635021 | -8.2299926837299 | -8.610693397199642 | -8.26261367489144 | -8.79875731419943 | -8.71266921420692 | -8.199285840608413 | -8.882194640419216 | -7.2083982219820895 | -6.661505790329818 | -7.088644311784217 | -8.010225823445346 | -7.498622438254593 | -7.539241587111671 | -7.570112780100148 | -7.478704021725649 | -8.384048945604697 | -7.639898895773672 | -8.371016863054049 | -8.120737399743918 | -9.206495434552261 | -9.297699870761331 | -9.691132723462218 | -9.07660866874086 | -8.963162780956646 | -9.61716481405766 | -9.074223855527341 | -8.721751301384975 | -8.835431243988586 | -9.638583481811299 | -9.467438615226571 | -9.394414774410517 | -10.017226472961218 | -9.79217343119993 | -9.944531181255252 | -10.359941457945828 | -9.89949091015896 | -10.29000123000833 | -8.89171365762014 | -8.568571971841006 | -9.266480154850173 | -8.755226941431365 | -8.508520997867477 | -8.732049340779387 | -9.180016388704093 | -8.624798581776782 | -9.288001260117197 | -8.68429136345761 | -9.493082541290386 | -8.945610772756618 | -8.937245386391776 | -8.774494690455649 | -9.66204048880877 | -9.860265740915223 | -9.349704555267754 | -9.244990133350639 | -9.508332336557732 | -9.60508661377088 | -7.7857626034602605 | -8.239860385786388 | -8.280564015131938 | -7.832656173970133 | -8.213837860495198 | -8.687705059726635 | -8.381229941584797 | -8.203214061972965 | -8.214881399868087 | -7.975132262823035 | -8.060956086430389 | -7.754138281606869 | -7.753186217393156 | -7.4880148270753875 | -7.816569739566801 | -7.446256445816934 | -7.358305373773756 | -7.482639814126897 | -7.944093267713469 | -7.7472568776320765 | -8.423556733893896 | -7.808083257539945 | -7.249404268400608 | -8.392470536842003 | -8.124000181196381 | -8.284410444428854 | -8.602188877786569 | -8.463403768408686 | -8.907552454989798 | -8.785631600922983 | -8.12940333984961 | -7.858506524263941 | -7.12808502677509 | -7.228558280119062 | -8.125145592942648 | -8.63179177387587 | -8.520915807327084 | -8.27084864214901 | ||||||||||||
| 387 | dUDP [-H(+)] | cpd:C01346 | -8.434053720807599 | -8.509934468948824 | -8.014270816972804 | -8.8838572121298 | -8.592389835640432 | -8.829992962756315 | -8.560478150750852 | -8.803248775145029 | -8.884814699656644 | -8.73505531300181 | -9.540269036184537 | -8.754680311826114 | -9.863196053692354 | -10.225554190084159 | -10.314117771626643 | -9.973421337221424 | -10.086236888514179 | -10.126676523757192 | -10.305578821377127 | -10.37221456915761 | -9.936283449657974 | -10.248849127292287 | -9.620632394262337 | -9.72967785067098 | -10.103470305174074 | -10.095845769570298 | -10.056450905503901 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.9262525330319 | -10.071515755164357 | -10.36559444151495 | -10.175608958483032 | -10.290105009191937 | -10.799873406844911 | -9.90371030800485 | -9.850079007854733 | -9.977045465742417 | -9.251898106248206 | -10.14463850462738 | -10.15737626951158 | -10.551393192286078 | -10.355770819172095 | -9.7721136117872 | -7.834403130807788 | -6.766364504327882 | -7.076906067422343 | -10.033160432073352 | -10.097317049421576 | -10.178248192909528 | -10.131736784875171 | -9.93272969241326 | -10.004031583668063 | -10.297581446055867 | -9.97259775399863 | -10.616000972470154 | -9.831909890337815 | -10.186548308405975 | -10.623701289685192 | -10.123070636614056 | -10.071870394304796 | -10.146281825126694 | -9.890039735833724 | -9.799821771649288 | -8.516029904426228 | -8.610262121795417 | -8.3392673286416 | -8.92590760083405 | -8.135236141288665 | -8.673288118254463 | -8.983284674256122 | -8.751062799496049 | -8.793328825157383 | -9.007249891679022 | -8.890413296746983 | -8.729525501673871 | -8.621371406461163 | -8.600992684453848 | -8.549475771107383 | -8.696889230968583 | -8.538432316607127 | -8.355922128366217 | -8.872437832322138 | -9.29543259817583 | -8.814852604581134 | -9.270034136719163 | -8.984124804831016 | -9.142172064663827 | -8.826730511321678 | -8.03887934187065 | -8.855501652560738 | -9.269119017455184 | -8.846644362750286 | -8.887686561680338 | -8.748822356145208 | -8.76675505050921 | -8.52448328299697 | -8.86686526699967 | -8.83005885053731 | -8.406720490010317 | -9.94045798972553 | -9.613644060001524 | -8.238528692582287 | -8.097312366753734 | -7.718104499927855 | ||||||||||||
| 388.945 | 5-Phospho-alpha-D-ribose 1-diphosphate [-H(+)] | cpd:C00119 | -10.393156130172656 | -10.980906226607136 | -11.41236380476441 | -11.24757544620377 | -11.25038231876949 | -11.292372138470101 | -10.729717649382922 | -10.79427137411757 | -10.870055281771451 | -11.126476012905048 | -11.470665783480495 | -11.030291833371793 | -9.386254181000496 | -9.423671114659184 | -8.73576101819071 | -9.297673872150483 | -9.288339279106193 | -9.762307368006173 | -8.99364022333995 | -9.44392824995778 | -9.404644189911826 | -9.447698479570825 | -9.627020224471492 | -9.894742717478895 | -9.978885737188273 | -9.349140433321955 | -9.135803048130555 | -8.475405361035401 | -7.834776161166777 | -8.325560972173191 | -9.652349316706184 | -8.01640922937851 | -8.348478235865871 | -8.187803221647963 | -8.14498891772149 | -7.941757525030018 | -7.737389857118027 | -8.163278030819907 | -9.284275220978964 | -8.560719272745827 | -8.981593332279003 | -7.715308120586064 | -7.300437881568411 | -7.482951447061882 | -8.729811593554095 | -8.05669998983425 | -8.236137457709807 | -7.892761624166235 | -7.6632375767148915 | -8.143017882938343 | -7.858071364796452 | -8.452490531458519 | -8.271067856381306 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.510097679460046 | -8.66218073966525 | -8.927554863520324 | -7.683766233521868 | -7.9484929022843 | -8.041764147984779 | -7.489058889721762 | -7.673714555055069 | -8.188908600721474 | -8.14418968171385 | -7.796632444262497 | -7.771570112770783 | -7.986120970053044 | -7.9865476761959755 | -7.5612736731722885 | -7.794944353530437 | -7.483271884920713 | -7.8909978637615845 | -7.081911630544409 | -7.223537236814424 | -7.38628107813441 | -7.924186265697962 | -7.438741431098168 | -8.193108218387016 | -8.036665375873708 | -7.2247466536959 | -8.399691970695459 | -7.35218557440187 | -7.693887660387486 | -8.035544806462823 | -7.432863787985385 | -8.686285496507738 | -8.300702806880725 | -8.046721655046806 | -8.064263409253806 | -7.0048604043860125 | -7.325974518500307 | -8.410468933726182 | -7.733070623869584 | -7.985869960189529 | -7.2089456837428445 | ||||||||||||
| 397.134 | S-Adenosyl-L-methionine [-H(+)] | cpd:C00019 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.473969030213544 | -8.838917849441358 | -8.879209059924317 | -8.72643221020701 | -8.513277022303932 | -8.488113036821716 | -8.616944563377787 | -8.7248447630895 | -8.931563958495415 | -8.825403760019274 | -8.37802210202046 | -8.753729474802068 | -8.606381879359647 | -8.796009008322283 | -8.672414599634955 | -7.653091467295197 | -7.68832610218726 | -7.552671843183646 | -7.110039492763282 | -7.823482643149694 | -7.472633517259763 | -7.584506969090981 | -7.864568570894269 | -7.77359520985955 | -7.545118304179529 | -7.4114433797076655 | -7.427401590523297 | -7.736393376544186 | -7.353238011641096 | -7.683666324990759 | -7.606641091431279 | -7.232623109015258 | -7.487846945873183 | -7.6793589383695755 | -7.577143516852078 | -7.4801742210843924 | -7.25339331957373 | -7.4024673865104 | -7.575477105922767 | -8.040226905050543 | -7.481886462239738 | -8.459844737522669 | -8.060724153914276 | -8.139105603158233 | -8.092668092303038 | -8.271945577815883 | -8.243002698819222 | -7.824536351659025 | -8.073025917081713 | -8.525725570975224 | -8.179697229695568 | -8.400753860444851 | -8.204897757616022 | -8.626115700506634 | -8.035939506662128 | -8.42013002082006 | -8.505468718689214 | -8.369456552487955 | -8.30436012452533 | -8.204266099756817 | -8.14476062212648 | -8.33284277442209 | -8.182854333024226 | -8.468437764719209 | -8.54181864645482 | -8.358197783065513 | -8.351325169061734 | -8.466922119258415 | -8.223224075474294 | -8.395781802239188 | -8.239812609758737 | -8.114403902840708 | -8.103460606128582 | -8.37078070108058 | -8.232390969696462 | -8.38879413348386 | -7.611680441514907 | -7.790021493997505 | -6.9480322543856765 | -6.37848593230744 | -5.35351035466409 | -5.791119525977593 | -7.089761613600315 | -7.191274801316942 | -7.3729359690598875 | -7.055017351480671 | -7.137449973056983 | -7.031681632109765 | -6.512749154140211 | -6.311836659397503 | -7.255089426579554 | -6.801781709539697 | -6.40222264007335 | -6.809316248282161 | -6.027446698428312 | -7.212714922971751 | -5.983513945168056 | -7.353404789567905 | -5.835352598914243 | -7.14662196297837 | -6.371566710747692 | -5.332235957544487 | -7.775344240262914 | -7.643505477201039 | -7.580218513536869 | -7.417808739833782 | -3.8877910110406857 | -6.968959354048291 | -6.934791173731429 | -7.10232522284733 | -7.251285586935734 | -5.504617090348877 | -6.900641018951949 | -7.441994699083446 | -7.480295903602048 | -6.412520254265494 | -6.834707806272003 | ||||||||||||
| 401.015 | dTDP [-H(+)] | cpd:C00363 | -4.0924076134579614 | -4.2442504741464635 | -4.267712579484511 | -4.239577444732754 | -4.146417715889368 | -3.8652913556799797 | -3.7864367032091026 | -4.16358706823914 | -4.035779241472378 | -4.189771775581234 | -4.183592931412469 | -4.091361490432996 | -6.427677107203407 | -7.090418549034142 | -6.547901724076952 | -6.533558843013624 | -6.869767449632532 | -6.57710436744047 | -6.094689962414818 | -6.428836753408322 | -6.543540446096983 | -6.112582176399118 | -6.431444917894075 | -6.413751270941681 | -6.881111823048817 | -6.784299208095832 | -6.471511985380264 | -6.543227553410328 | -6.4057638676570745 | -6.457461026374091 | -7.457240440007626 | -6.490446838160085 | -6.769129894636617 | -6.642145780107194 | -6.767102275302456 | -6.764381070547029 | -6.602155226885006 | -6.838363312849415 | -6.943749220031262 | -6.569120405647244 | -7.132246846892921 | -6.256513591314047 | -5.891298574718061 | -6.120941749492779 | -6.669203400707143 | -6.343568083122568 | -6.51667014722749 | -6.394425552419556 | -6.337336606150355 | -6.807734014939263 | -6.39903732191652 | -6.75485331815517 | -6.722768388659739 | -4.8620963191011 | -4.962531195680845 | -5.2247839508707905 | -4.866583825355534 | -4.577486227057347 | -5.029188745732786 | -4.556134755506609 | -4.761429979175935 | -4.929040922091161 | -4.989240725233012 | -4.971445105107203 | -4.707214706121137 | -5.677521278735498 | -5.2233535765471215 | -5.4814582987635925 | -7.147360208800257 | -7.4510428999956915 | -7.466132742924961 | -4.688884291572567 | -4.491591473826982 | -4.473148832087866 | -4.52456867667531 | -4.51993202165869 | -4.626557853215605 | -4.718990925138493 | -4.47243716377843 | -4.546560337646285 | -4.35148124284258 | -4.7483657828865 | -4.761005538001316 | -4.732896027316163 | -4.664285460365141 | -4.673423879072702 | -4.562863556764046 | -4.530655190716334 | -6.581999581735762 | -6.70024207349586 | -6.902457489118828 | -6.748697448824507 | -6.1132703776136985 | -6.366927890052006 | -6.499151519753588 | -6.462300824590878 | -6.091386879249621 | -6.562130197342652 | -6.859217632944651 | -6.7875634890975975 | -6.611828996483062 | -6.600766140699442 | -6.477826481107054 | -6.252791909951044 | -6.434275825865653 | -6.314531626669731 | -6.099931834868261 | -6.315374219373255 | -6.4964991565249095 | -6.508335345475996 | -6.800682685627634 | -6.7129905712122255 | -6.476180026396814 | -6.287816033506354 | -6.536696092073992 | -6.603842249761734 | -6.45398007559754 | -6.327833021698733 | -7.249617996411368 | -6.336972928308914 | -6.510531662985523 | -6.55285496996285 | -6.502173849770559 | -6.472958749255347 | -6.4979929439319015 | -6.546122650026601 | -6.289874504021569 | -5.562763172717276 | -6.193548583304353 | ||||||||||||
| 402.011 | CDP [-H(+)] | cpd:C00112 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -4.653797603856461 | -5.344842342610257 | -5.640540335599722 | -4.873440640270686 | -4.765172011113699 | -4.0375378313595505 | -4.661881345606342 | -4.347799092504353 | -3.9789845402591517 | -4.530359906460141 | -5.295160352597411 | -5.3348862883647685 | -5.708319931427215 | -5.391252712698229 | -5.387060466942817 | -5.560717542136983 | -5.351226237061043 | -5.463023722603333 | -7.005679367064262 | -5.534852688909479 | -5.845743357212702 | -5.810397285269278 | -6.071277968075875 | -6.149478673811397 | -5.801104929413762 | -6.096819857186574 | -6.368968057087767 | -5.728351695597444 | -6.433245369923948 | -4.856053000121955 | -4.531905345704432 | -4.812557271166817 | -5.772144898663372 | -5.292723203064097 | -5.314660458223975 | -5.289466830599365 | -5.083659954937778 | -5.9028028750124895 | -5.067151698854011 | -6.045188091952287 | -5.4254785345106935 | -6.62270266737638 | -6.966195430962808 | -7.068329818385568 | -7.278816409159806 | -7.126641153912254 | -7.8200417745818065 | -6.506261641868675 | -6.242606561044786 | -6.197545363001687 | -7.0507754163553615 | -6.9729992338891 | -6.72665325916282 | -7.833440618906666 | -7.362993649570792 | -7.1644273961229095 | -9.140073859479314 | -9.366608684615585 | -9.157274730219257 | -6.432381168766314 | -6.2500816882444505 | -6.644611111884041 | -6.5972896379825094 | -6.048144968803988 | -6.411088869347727 | -6.878691101552325 | -6.30090607546249 | -6.90588251109382 | -6.485798184364127 | -7.152236575818996 | -6.5835771271462225 | -6.641667472875934 | -6.428106920201541 | -7.14506065337555 | -6.821976688722571 | -6.798369029416056 | -7.700032508877178 | -7.694813543335183 | -8.07768684292001 | -5.293737572412029 | -5.734094186041581 | -5.920384258502716 | -5.595113074571714 | -5.898993287646207 | -6.243016727100689 | -6.009044152271638 | -5.767198931872806 | -5.952201632702393 | -6.31179389736694 | -6.28771127616152 | -5.908837600292065 | -5.853439888389873 | -5.629379550843862 | -5.992980598904742 | -5.255252562485059 | -5.169349984140154 | -5.430501766759858 | -5.994466772406124 | -5.689814403061441 | -6.5246710621558 | -5.697783263159576 | -5.284562710292395 | -6.525542009797775 | -5.3840012492465235 | -5.643985329877897 | -6.176860480913767 | -6.280092259908495 | -6.345535211649216 | -6.417918358734672 | -5.910361523486041 | -5.8459132188156095 | -5.012269657810905 | -4.995054171939044 | -6.027680261579776 | -6.812698075608467 | -6.574585724559589 | -6.301717378403055 | ||||||||||||
| 402.996 | UDP [-H(+)] | cpd:C00015 | -5.441363053835178 | -5.329232582855364 | -5.039567521936718 | -6.063157218591877 | -6.36419944375853 | -6.111458480982214 | -5.254735578168171 | -5.434327228133748 | -5.894665006799614 | -5.474436325692648 | -5.60737709422422 | -5.492376416256194 | -4.430089798322817 | -4.996852273103615 | -4.719950865330081 | -4.66690850870486 | -5.1789373355584924 | -4.958927944779656 | -4.450106375649391 | -4.617290692250066 | -4.728483967940888 | -4.247362141436298 | -5.048551963067128 | -4.761664687840043 | -5.323993455686927 | -4.98760899660917 | -4.673964761345369 | -4.839444044392479 | -4.501109756692067 | -4.848605604909473 | -6.370535537475702 | -4.90680969811084 | -4.961636292805838 | -4.962664704123913 | -5.156436491841623 | -5.187813545834726 | -4.829972582671374 | -5.010494523679656 | -5.782800113025128 | -5.209974139793357 | -5.920272285078443 | -4.425615905333544 | -4.096528654030677 | -4.16413531007961 | -5.461613589430695 | -4.876377329927828 | -4.973445365789076 | -4.822168509308644 | -4.433208614597219 | -5.436589108146967 | -4.3803994657286625 | -5.391642327298635 | -4.796159831967674 | -6.418461794536124 | -6.640248059427867 | -6.755095087896621 | -6.394514880327152 | -6.334206544971497 | -6.895564856648487 | -6.147842808746506 | -5.9541551267300346 | -5.9294616594403005 | -6.69844565364307 | -6.77560919073205 | -6.487184328326762 | -6.972269725698127 | -6.291948490626239 | -6.046754171567442 | -8.112219875524648 | -7.755124995748847 | -7.57964055608784 | -5.8718315283329385 | -5.7922555502262085 | -6.28793043605915 | -6.077777782486508 | -5.3963211131851985 | -6.0219725151866665 | -6.404281966031498 | -5.874216055301601 | -6.511528122251319 | -6.0803012256714615 | -6.80253048232841 | -5.968326507696684 | -6.134099721680578 | -6.0334487416029345 | -6.68284761479415 | -6.531224079721733 | -6.483308215710825 | -7.214121683260026 | -7.361265736030794 | -7.49828433998224 | -5.222517420482659 | -5.407316543487277 | -5.670472727636178 | -4.756784005865179 | -4.9318170645401285 | -5.489346407008906 | -5.201074769900291 | -5.0333141795300165 | -5.12580294475017 | -5.403977925245856 | -5.395459175189533 | -5.1197372270953485 | -5.012115377572931 | -4.818562964553464 | -5.144205434285994 | -4.539115191622416 | -4.439188156375405 | -4.75351841054978 | -5.323025063760796 | -5.017820765519662 | -5.835323465311539 | -5.137810405604866 | -4.560515145794286 | -5.900264025817066 | -5.017586880986571 | -5.301586930426835 | -5.484221064834734 | -5.571742155242924 | -5.513932113797008 | -5.556163631029412 | -5.40645317956096 | -5.3401109598742 | -4.5644896949533535 | -4.608595779641318 | -5.469097236824948 | -6.311038158212145 | -6.061458626921646 | -5.919493959076783 | ||||||||||||
| 403.12 | S-Adenosyl-L-homocysteine [+F(-)] | cpd:C00021 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.588895038189803 | -8.547383562019473 | -7.360762300800648 | -7.772295598510167 | -8.366475271794853 | -8.339104242188604 | -8.146570022139928 | -8.377120234590194 | -8.427692624732535 | -7.789430883904214 | -7.199847167537404 | -7.7322662325304945 | -7.9132422377837415 | -7.608422643911276 | -7.263055508055519 | -4.4513283188396615 | -4.504048447876525 | -4.402018585554376 | -6.79889834390579 | -4.60703406000067 | -4.176838443932294 | -3.808804241732379 | -4.640687706485305 | -5.3301291239055635 | -4.579877821192223 | -4.209406710346335 | -3.8898542212098843 | -4.839986692871236 | -5.745581988287064 | -3.1276661526252423 | -3.6179336836008322 | -3.308236541718014 | -5.045491058173094 | -3.6992702885364253 | -3.5309240217355433 | -4.163340531311092 | -3.801306960544044 | -4.389695643201842 | -4.192972622653134 | -5.42483963589011 | -4.437216996578038 | -7.594848106610002 | -7.244856146188213 | -7.526293639902 | -7.542460288020303 | -7.397309442755148 | -7.595877070502474 | -7.925851357687204 | -8.161685033452958 | -8.133523990319732 | -7.721025657846413 | -7.661030429017135 | -7.543942143214285 | -8.02958698469699 | -8.030491508816628 | -7.786438992024472 | -8.14499340534568 | -8.256362889190427 | -7.88769477766482 | -7.165849261551593 | -7.48065608090934 | -7.542490096936767 | -7.6500695629442514 | -7.439989441980203 | -7.8063092478736875 | -7.411853070612823 | -7.438828132488026 | -7.571608285766592 | -7.529126189408555 | -7.585663589427061 | -7.3541154717594 | -7.593980581538589 | -7.47637696246344 | -7.550222151893817 | -7.563828664671508 | -7.400539063897573 | -5.085296739885245 | -5.995567890813374 | -4.6862327958640035 | -5.972636552779424 | -6.76022800974121 | -6.59977519464145 | -5.857426429260836 | -5.918333531418208 | -6.666223167246805 | -5.9957851507308435 | -5.2764073969098115 | -4.9651028777591355 | -4.469859848072403 | -4.604388060933569 | -5.603036271118797 | -4.748879217867172 | -4.685731091054768 | -4.960907497254704 | -6.715277882990894 | -6.41588020030132 | -4.321713331969243 | -4.852321755621213 | -5.015625797315608 | -5.704246584649928 | -5.577779724058453 | -4.767266795737922 | -6.659745645735897 | -6.274164498553825 | -6.209716414476435 | -6.835538903959232 | -4.896673493879186 | -5.726067878169799 | -5.702248288597626 | -5.528993812102535 | -5.657354365628621 | -5.1325545193131425 | -6.871496945573951 | -6.829440303681293 | -5.231023936002524 | -5.961574950324837 | -5.778265936027751 | ||||||||||||
| 406.017 | dCDP [+F(-)] | cpd:C00705 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -10.32714410591584 | -10.809094815850049 | -10.170076138514467 | -9.716180425641879 | -10.644694258496877 | -10.44480658099063 | -10.190865252538924 | -10.205962776223425 | -8.048284923384504 | -9.516385794490882 | -10.212375696478476 | -10.473846763750357 | -10.531126242672235 | -10.761784134634794 | -10.606779247363255 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 407.01 | dUDP [+F(-)] | cpd:C01346 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.941605284167824 | -10.17475010940599 | -10.012315305672852 | -9.452999089071767 | -9.823405693298275 | -9.440678003178157 | -9.108196291777995 | -9.92587897298069 | -9.680801848946924 | -9.76294662572001 | -9.835408165033455 | -9.986616918779255 | -9.900256055631225 | -10.314134595183416 | -9.90484787405834 | -8.922400294360882 | -9.121003020323863 | -9.00010413976217 | -9.227521049903538 | -8.929499821917082 | -9.204773176337168 | -8.885605449002906 | -8.87968153270525 | -8.933588864548563 | -9.417017297429659 | -9.719344006500286 | -9.16632666248868 | -8.938148262507584 | -9.035563190698657 | -9.557016354693566 | -9.13243290649236 | -9.419737300004035 | -9.010813350520086 | -8.954303508774435 | -9.224747337786521 | -9.135443231279686 | -9.370279650458656 | -9.260006515595977 | -9.168056974014686 | -8.735392711963074 | -9.286822429838896 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.352878813416382 | -8.091234111060754 | -8.079127495083789 | -8.847076873566971 | -8.026785075841799 | -8.377112820263761 | -8.863062714595998 | -8.632447615221238 | -8.571613625703968 | -8.417024611497169 | -8.701879190856095 | -8.52644899497304 | -9.16185386125487 | -9.0150144165423 | -8.694881771498848 | -9.006561121304488 | -8.942823967409028 | -8.352515069300052 | -8.361920019057044 | -8.649289967783655 | -8.84277026877223 | -9.248186669227973 | -9.137300670150525 | -9.29024219468281 | -8.942455163863206 | -8.798859922920151 | -8.565771563560443 | -8.971673894426685 | -8.572937589406843 | -8.66492497986186 | -8.722946323670351 | -8.949855845043112 | -9.018963866759064 | -9.012516309216696 | -8.640766382737734 | -8.487828673679857 | -9.23374717806917 | -8.747265427587447 | -9.101765724846166 | -8.798582561313179 | -8.90810779114383 | ||||||||||||
| 408.947 | 5-Phospho-alpha-D-ribose 1-diphosphate [+F(-)] | cpd:C00119 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -11.718928311707645 | -11.707065553897579 | -11.844017926527949 | -12.092861951212317 | -11.084898982791424 | -11.79852598925036 | -11.411483133880767 | -11.545919397398402 | -10.119272187869603 | -11.472240625372745 | -12.222550748964617 | -12.086334028074068 | -11.907014145556483 | -11.963873786970515 | -12.32019418362496 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.833632800599608 | -9.830206608412663 | -9.69180121281767 | -10.151078328717746 | -9.472647108938816 | -9.53310916475112 | -10.169585207473558 | -9.995494971793319 | -10.108328427072706 | -10.366455004764743 | -10.032807340561655 | -9.874029610513519 | -9.548693159562983 | -9.811096435920318 | -9.63360237371213 | -9.790569192180074 | -9.665594062542077 | -9.63968120123738 | -9.89291363252536 | -10.397561054354163 | -9.811053160474783 | -10.097898999356461 | -9.948912009145204 | -10.169019894591068 | -10.060722555461282 | -9.373854176211962 | -10.272893973544555 | -10.120388642614323 | -10.096538396239339 | -10.042898079525475 | -9.727933633356637 | -9.879945007712893 | -9.727347741998978 | -10.08054431448659 | -10.08749984145566 | -9.221072295719798 | -10.435072048651222 | -10.593498303540724 | -9.037075146310853 | -9.327183062272324 | -7.970614719898752 | ||||||||||||
| 410.027 | dADP [-H(+)] | cpd:C00206 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.275006111990104 | -8.166517860910353 | -7.685971440427392 | -7.2979907972521385 | -7.787967766414778 | -7.398016466355307 | -7.104109337477517 | -7.209238145232085 | -7.32584755553172 | -7.090542963892043 | -7.202110627266551 | -7.38374291445902 | -7.709865989003635 | -7.697768432245933 | -7.290363645131185 | -7.430419788846551 | -7.20699548316438 | -7.318214563799136 | -8.903444658732809 | -7.240571411432031 | -7.885871393528157 | -7.7820187728579375 | -7.846437055820972 | -8.245317577400163 | -7.845333385272237 | -8.310349534615714 | -8.523112769674393 | -8.11911768806717 | -8.842587884911207 | -7.075047850172734 | -6.362161957121976 | -6.934765513334846 | -7.711672208746926 | -7.353866884521118 | -7.48806050269551 | -7.4759342758739065 | -7.36531047030409 | -8.284906328374934 | -7.378309287852921 | -8.252598788275566 | -7.860851737393113 | -8.826858841731239 | -9.13654332510149 | -9.293635540543285 | -8.936638803782017 | -8.466336843285253 | -9.036593251761287 | -8.157869383496529 | -8.004616414097745 | -8.083733543817312 | -9.473786296208104 | -9.342174995892032 | -9.247456446126176 | -9.67425081615742 | -9.28577676711844 | -9.22275150095103 | -10.301221560450404 | -10.135943611372053 | -9.80764106160536 | -8.553393302975232 | -8.406583648832108 | -8.814299017301002 | -8.680605754023038 | -7.944083386922128 | -8.877290888694114 | -8.872930710559158 | -8.186716658785654 | -9.06886136321375 | -8.835649523676269 | -9.527360489659292 | -8.812704637499081 | -8.946338545638184 | -8.648001930963794 | -9.58964072713143 | -9.714051274853905 | -9.380278319693828 | -9.363207355698544 | -9.603600476757217 | -9.332112180171887 | -7.63225982332649 | -8.061673795831707 | -8.265486524720234 | -7.425229776831618 | -7.814112297349 | -8.176899585644852 | -8.117068215493324 | -7.834415268143616 | -7.79366336385709 | -7.530082232474071 | -7.6968601236984 | -7.471215605512243 | -7.36648953262104 | -7.0754159536338435 | -7.488125748771744 | -7.442358391386755 | -7.137896719132572 | -7.0774432345029386 | -7.7600776498421755 | -7.41670205043576 | -7.978766259768631 | -7.634968156384612 | -6.8345228469271975 | -8.257425539822306 | -7.8451917038017305 | -7.986522310684637 | -8.219383184547585 | -8.270641185609561 | -8.669680382548343 | -8.429083606874183 | -7.904452251652566 | -7.550536523117596 | -6.79934755159781 | -7.070374369449773 | -7.7417101733362665 | -8.15050719605137 | -8.332356683896547 | -7.866429977467587 | ||||||||||||
| 417.019 | P1,P4-Bis(5'-adenosyl) tetraphosphate [z=-2] [-H(+)] | cpd:C99999 | -7.923347165964078 | -8.034872845131725 | -8.029160955784583 | -8.04694409271373 | -7.625929468654883 | -7.800696200549897 | -7.651561539192036 | -7.919688131928524 | -7.762152874874792 | -7.814563228808523 | -7.853353739452054 | -7.732313497248799 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -6.917688874462076 | -7.013801180548045 | -6.640293327528901 | -7.047568723147827 | -6.870866932501925 | -6.967642002028473 | -6.829110579285998 | -7.2719935295675775 | -7.108567439925277 | -7.089947206672565 | -7.1471651292696965 | -6.968275371142665 | -6.710842684970357 | -6.983189477641685 | -6.865840528421909 | -6.385598995680417 | -7.124906456802657 | -6.749123833462125 | -6.840582956309773 | -7.368585786370396 | -6.724675039498257 | -6.584929700254956 | -7.1403607498790524 | -6.798902597792597 | -7.066007145508355 | -6.900442784096689 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.812842377879322 | -7.879451316757313 | -7.980463338617724 | -7.776946450933613 | -7.749864751907853 | -7.637647730446486 | -7.670925376088568 | -7.746251790155614 | -7.8450378474547815 | -7.8043270209509465 | -8.028094773893635 | -8.003840712775515 | -7.510729552112675 | -7.658532777532502 | -7.600592086839072 | -7.818656037022619 | -7.487463908046023 | -7.902486263046023 | -7.1820307769605085 | -7.695568287185202 | -8.099917622465858 | -7.677836832464956 | -7.733175108772259 | -7.6584901738792315 | -7.45984684202 | -7.6146081801528975 | -7.576411761110013 | -7.759256874329642 | -7.754707492727592 | -7.730375349585319 | -7.410505070095517 | -7.4279761936763125 | -7.7663385548285 | -7.716238911603025 | -7.7278333291750405 | -7.74654022993399 | -7.575742275924952 | -7.453911309534178 | -7.28276997933691 | -7.296705946711748 | -7.111022460338556 | ||||||||||||
| 417.137 | S-Adenosyl-L-methionine [+F(-)] | cpd:C00019 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1.5104073174496757 | -2.264788845070612 | -3.8363295340625942 | -2.339775742178335 | -2.4400813500139154 | -4.110887320798392 | -4.017193343529904 | -3.2844732917430255 | -2.663510218539953 | -4.068821481316334 | -3.608174631716143 | -3.348990836333508 | -3.4609807517342275 | -1.8267897725512412 | -2.973467339986278 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -4.709577182249586 | -4.0973032175339545 | -4.220659315991092 | -4.15076947765765 | -4.2006605117752756 | -4.15655556040713 | -4.878519045494978 | -5.344794461305382 | -5.525137049097979 | -4.731246075736142 | -4.9083997192418325 | -5.0473568987085216 | -5.652187022811258 | -4.918679236525057 | -4.4736573614410275 | -6.449280893863006 | -6.451848895080712 | -6.3758007874605225 | -4.105578748499448 | -4.374445015760092 | -4.382602097837743 | -4.694406286007498 | -4.4597578473941235 | -4.472978105147981 | -4.247959650441359 | -4.454091744298564 | -4.463920942165506 | -4.276419030192508 | -4.456682310615488 | -3.9523066133432287 | -4.283328648682874 | -4.288555437317586 | -4.377089561306773 | -4.4148536244861045 | -4.510002693899214 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 421.02 | dTDP [+F(-)] | cpd:C00363 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.275677170028882 | -7.320544457170089 | -7.599919058813199 | -7.386932433570357 | -7.139448144687449 | -7.0572339565129045 | -7.737799023993061 | -7.298650404030776 | -7.519486734782199 | -7.803582386571321 | -6.918952571238422 | -7.372747168890177 | -7.187721021845526 | -7.345455000632142 | -7.556847694955551 | -6.801885553454901 | -6.780033088999572 | -6.265970939447606 | -6.071679050890586 | -6.299401342170499 | -6.6686105329170395 | -6.926308392025471 | -6.604994174550557 | -6.698659478646764 | -6.879425381917559 | -7.105634782465167 | -6.479632791628982 | -6.339382885896679 | -6.306246872406368 | -7.361399106879255 | -6.899137624024658 | -7.764519386715794 | -6.251026707920354 | -6.8454945190646095 | -6.983994424480824 | -6.657262560907694 | -7.149494703993396 | -6.495900142050745 | -6.857157033774521 | -6.41109730216247 | -6.747252290902359 | -5.968436385931594 | -6.1954206609210045 | -6.176036050441593 | -6.088331861581962 | -5.785906783156049 | -5.898273614274112 | -5.4771507078042765 | -5.414127810378151 | -5.625644183995877 | -5.999929496929745 | -5.592181833847714 | -5.543799387900871 | -6.681287997630151 | -6.269317748986576 | -6.362523312047267 | -7.5495081810570746 | -7.532044830362522 | -7.463752062613996 | -6.092253294745087 | -5.798286480794833 | -5.8549808765782325 | -5.667221060874951 | -5.9101706800381315 | -5.810509376684635 | -5.928835329948337 | -5.546731500613554 | -5.8969753119144945 | -5.672490679099881 | -5.817877116630932 | -6.127436810968937 | -6.055179790200372 | -5.9517631545505605 | -5.828870894571218 | -5.632895844129479 | -5.540779643213747 | -6.743903608888572 | -6.5626171479671855 | -6.996868225769805 | -7.239600369189514 | -6.347230269924261 | -6.499215490341906 | -6.866159950038361 | -6.667337900907063 | -6.106891225757267 | -6.77021370391766 | -7.477400766507839 | -7.3476986864541445 | -7.375593720396973 | -6.975316269864857 | -6.96386529522324 | -6.809850136758757 | -7.364480471811924 | -7.008496334063393 | -6.366017586095987 | -6.912172013928243 | -7.800239091340988 | -6.976728916285213 | -7.551798371995122 | -6.929501794971217 | -6.93303460474319 | -7.448046545120984 | -6.528846165055281 | -7.0611903693063836 | -6.746539064985724 | -6.254294442961916 | -7.110648542510556 | -6.420041450890901 | -6.792273900504803 | -6.679194194456621 | -6.861541848450953 | -7.305227707768915 | -6.881905697661506 | -6.449305673283731 | -6.432591987055041 | -5.957188190914358 | -6.355807158889602 | ||||||||||||
| 422.998 | UDP [+F(-)] | cpd:C00015 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.822739972987227 | -9.505156377229639 | -8.928963235375136 | -9.008385520060525 | -8.970795344989122 | -8.84254193733147 | -8.557368244416628 | -8.748030157381793 | -8.682695064033638 | -8.430398220479796 | -8.657807710736575 | -8.820743836935058 | -9.238456465210264 | -9.132661243889268 | -8.957949958171346 | -8.481195645510098 | -8.24198538239374 | -8.284555384098166 | -8.931694520132982 | -8.190710615982253 | -8.719511127323992 | -8.401851976889454 | -8.43085715568308 | -8.249773633172556 | -8.433217650667533 | -8.69505849988118 | -8.520177780863806 | -8.269825976639408 | -8.788799264088226 | -8.508973352869319 | -7.80170216346127 | -8.130632206680982 | -8.382850627835598 | -8.210105051301701 | -8.549370878957594 | -8.363161133660661 | -8.41468059175708 | -8.531281599063242 | -8.189532371819258 | -8.176850122418658 | -8.368384682559478 | -6.413217142918168 | -6.3980106212397025 | -8.029809566014432 | -6.601582123786358 | -6.172352623049534 | -8.442542920655972 | -6.663033913276441 | -6.92385939464751 | -7.263934343994986 | -7.314362137409978 | -8.549213621979588 | -7.260418017970351 | -7.749388985257497 | -7.187942007488296 | -9.00285682205318 | -8.24001269540716 | -8.820949102617089 | -8.716173432608183 | -5.471608330306658 | -5.552483363863878 | -5.497414913738574 | -6.193802538092186 | -5.4596687033672495 | -6.321246028555743 | -6.6717712339949315 | -5.9099053614314245 | -5.841794280748423 | -5.459363932801409 | -7.783303406407042 | -6.189975309340365 | -6.352952659054196 | -6.181487737417517 | -6.773896332195563 | -6.569497994180203 | -6.599012531144724 | -8.524826422080983 | -8.607465948889494 | -8.774601646241566 | -8.626256282161659 | -8.292655235875417 | -8.536155436358946 | -8.545312806779963 | -8.467862578395804 | -8.557398905843252 | -8.67990066564966 | -8.725081277698786 | -8.688241733779757 | -8.472814150872757 | -8.687330466596832 | -8.41028696409727 | -8.344181227243192 | -8.492179553574065 | -8.307012331499518 | -8.18332704198456 | -8.30273210724538 | -8.281338828371203 | -8.570768013420073 | -8.596353197518166 | -8.805615840994857 | -8.471811782095582 | -8.036840598242275 | -8.591802742243088 | -8.570703572331988 | -8.56453578868477 | -8.50405237770749 | -8.765971586476288 | -8.630936876521371 | -8.589183568629476 | -8.573702007665634 | -8.500203506910697 | -8.267055590728432 | -8.488073020907603 | -8.601021987868439 | -8.402140519893893 | -8.270951719063579 | -8.326622167042698 | ||||||||||||
| 424.038 | Thiamin diphosphate [-H(+)] | cpd:C00068 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -10.687764789179345 | -10.406035640958738 | -9.859765654864319 | -10.178108490120854 | -10.741410802352705 | -10.205380378326026 | -10.524044089929081 | -10.207791379887519 | -9.777627325828945 | -10.705811366720015 | -10.96674398990631 | -10.269723395274934 | -10.945112807412778 | -10.210692274135724 | -10.519434333615331 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.08901784370671 | -9.385090913576088 | -9.046260779995576 | -9.185858851819626 | -9.111967716735146 | -9.276176294203282 | -9.17033806473824 | -9.258398063841428 | -9.500384496086038 | -9.220318875579844 | -9.169536398076447 | -8.960354119896854 | -9.137670157727527 | -8.910922009907333 | -9.180986811534353 | -8.958377982189868 | -8.711803119960763 | -8.845221085868612 | -8.952154809537532 | -9.252052666695912 | -8.700061367948308 | -8.811621914604904 | -8.894876185322513 | -9.119447172147401 | -9.130975966214105 | -8.693275604226812 | -9.23425681565627 | -9.274890713117102 | -9.265401236708078 | -9.309925032322974 | -8.730757433215889 | -9.095626717087923 | -9.175643579989208 | -9.126213034205085 | -9.13895941646061 | -8.90607370812671 | -9.288100162795491 | -9.359590254321208 | -8.735366296058688 | -9.083073057505526 | -8.773178670241112 | ||||||||||||
| 426.022 | ADP [-H(+)] | cpd:C00008 | Adenosine 3',5'-bisphosphate [-H(+)] | cpd:C00054 | dGDP [-H(+)] | cpd:C00361 | -3.6545067033665437 | -3.555220738972134 | -3.568465062287146 | -4.241964735587164 | -4.644380595531816 | -4.623607514309762 | -3.533371744745055 | -3.7067825354519575 | -3.938098804016512 | -3.561870628069867 | -3.9094500231176377 | -3.725927841087166 | -5.7790286914435836 | -6.471943633848411 | -5.973652163067927 | -5.423678969194444 | -5.382922171433683 | -4.850955896794748 | -5.081992342562748 | -4.980500524929301 | -4.5991363522013415 | -5.218858805323803 | -6.040235509986512 | -6.5896285480546055 | -6.085368327752751 | -6.62336666926481 | -6.5140290097692075 | -3.1273522426258133 | -3.039364093401502 | -2.990777619612318 | -4.968665230102841 | -3.0536094502799456 | -3.63952602982267 | -3.6231445445894757 | -3.7633989136745365 | -3.8671101142147135 | -3.595592921056087 | -5.2267099282138885 | -4.022442641167869 | -3.323322071351783 | -4.250879015416896 | -2.41302019347499 | -1.9542738466799827 | -2.437849578645402 | -3.575509249250041 | -3.233889747702234 | -3.339057355619161 | -2.859048113924918 | -3.007940284071241 | -3.7268594570936324 | -2.516019388823359 | -3.745118462954961 | -3.1024706595792875 | -5.11057690659578 | -5.709230607727643 | -5.768429632389995 | -6.084199229153624 | -5.8067736038110525 | -6.770459717383666 | -4.5235519318002115 | -4.194996393527779 | -4.08165668507435 | -5.882774161615946 | -5.751362494636072 | -5.420024000435128 | -6.534043244960216 | -5.977182528401245 | -5.63562098330222 | -8.764140346426649 | -8.540617759277891 | -8.514512624762801 | -5.082517435482713 | -4.827530984907295 | -5.42622636729932 | -5.036094986593636 | -4.5017089158254295 | -4.907165716994611 | -5.703231923068818 | -4.669724797475527 | -5.7473153410239926 | -5.1895342502494035 | -5.875059729371891 | -5.715603005817601 | -5.217335732289065 | -4.852833890851784 | -5.985030563922371 | -5.838038385867447 | -5.460382959968981 | -6.417988750051729 | -6.614865901217744 | -7.0742907125771755 | -3.6033433899175975 | -4.087320351215741 | -4.186474867613264 | -3.3349214789123907 | -3.692691490013007 | -4.244152683397523 | -3.824899504641355 | -3.481365352992291 | -3.8329859781670956 | -3.9070353251371586 | -4.199937119525958 | -3.503672420558583 | -3.5469708542151235 | -3.3328015882079423 | -3.793951449980598 | -3.278943890678894 | -3.24606092251568 | -3.4710068103743157 | -3.7554738987455547 | -3.325262349243088 | -4.280544576197365 | -3.4093197585005273 | -2.936218946871421 | -4.3776230604816755 | -4.0176073025332775 | -4.045569218547396 | -4.220545254248 | -4.234100510338799 | -4.321335285912279 | -4.188928262798553 | -3.952670054620507 | -3.9370124094058663 | -3.115870771647012 | -2.9825715765613667 | -4.093055981400409 | -4.888178708732333 | -4.60594309080899 | -4.543379073903625 | ||||||||
| 430.036 | dADP [+F(-)] | cpd:C00206 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -10.485650831880012 | -10.373972218379 | -10.843438857423283 | -10.980341980746552 | -11.465719690666175 | -11.743264716424475 | -11.093518535782689 | -11.156767918093601 | -11.208685903163877 | -10.880123233277615 | -11.096728927132219 | -10.816694249724279 | -11.498902013213883 | -11.621137693292303 | -11.415447019476261 | -10.97258777070674 | -10.563023804808102 | -10.862362672561925 | -10.684962810329132 | -11.17195272041189 | -10.773021289884264 | -10.94400821628641 | -10.879225477256998 | -11.058183426753049 | -10.869310808212758 | -10.92060761279703 | -11.145115032927658 | -10.692920022049085 | -11.229283845618397 | -11.167879183009342 | -11.009669564911691 | -10.840900274390542 | -10.92339202806622 | -11.172878524523622 | -11.549069010573602 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 442.017 | GDP [-H(+)] | cpd:C00035 | -7.57088953897846 | -7.279506269601666 | -7.1706537570654145 | -7.659607856475572 | -7.8053819760631304 | -7.713982848994256 | -7.184735208733003 | -7.375191342434447 | -7.9115205455332696 | -7.919135292542696 | -8.151545896446626 | -8.07223080290081 | -7.166062982027532 | -7.625045959840412 | -7.826964517823476 | -6.987584835671664 | -7.0794205407231585 | -7.070881008529934 | -7.560850102713462 | -7.201452239094043 | -7.52169157432116 | -7.88392121436729 | -7.075697336936529 | -7.204428273943632 | -7.041124193231679 | -6.930205430377082 | -7.055025341298631 | -6.100219231679702 | -5.70952283902142 | -5.832491981687554 | -7.407120186949179 | -5.8250927136752315 | -6.386462453218967 | -6.358886793841029 | -6.349847697354504 | -6.34646348679894 | -6.025962464717714 | -6.555762339998925 | -6.835827674850959 | -5.938334020468132 | -6.805691208472154 | -5.730897503784907 | -5.32459216037251 | -5.572309715817397 | -6.50647745141282 | -6.311522879860321 | -6.296430721757351 | -6.055115913610304 | -6.005697795440663 | -6.637668375731101 | -5.278225468981215 | -6.333402406590226 | -5.821129108310273 | -7.825798046416768 | -8.18540608706457 | -8.368976926351857 | -8.72070355095913 | -8.790517315648234 | -9.06141742505775 | -7.680821186010711 | -7.4425607175931265 | -7.4274121806734765 | -8.50278172921514 | -8.530984938799353 | -8.284302502416951 | -8.855779082595056 | -8.420775915434348 | -8.388941329884844 | -9.816874895715667 | -9.694511115830391 | -9.542344669144104 | -7.609438763219697 | -7.371637389085654 | -7.801098370681888 | -7.877613699849007 | -7.166477170926327 | -7.748214523304531 | -8.13491473244655 | -7.344092877582666 | -8.23304297834184 | -7.60250400751158 | -8.384370397939064 | -7.800591113048105 | -7.845592616782119 | -7.703797417610959 | -8.448806008399696 | -8.35620363833143 | -8.186189842169574 | -7.971679151777488 | -8.08123970050658 | -8.24718733810911 | -6.334823256218087 | -6.537919338551108 | -6.701204942722047 | -5.933260898598222 | -6.1153854856614425 | -6.567915690001051 | -6.165017910846826 | -6.035520495650171 | -6.145156350462079 | -6.322208674987246 | -6.513229484625077 | -6.0552994439229915 | -6.296522972018156 | -5.97931201536426 | -6.255445675989108 | -5.518337493607658 | -5.547636717613001 | -5.734448155680133 | -6.332618658819046 | -5.723758143238656 | -6.598768361005428 | -5.975696461510303 | -5.452139256972724 | -6.558979820285675 | -5.940229212429076 | -6.055904842311115 | -6.350951994558079 | -6.1366550003139855 | -6.654465025993199 | -6.4939840618717835 | -6.622881456662812 | -6.587328501192158 | -5.875181163942101 | -5.862385438231298 | -6.678222353735172 | -7.063377014874615 | -6.84663349945755 | -6.985673916186606 | ||||||||||||
| 444.045 | Thiamin diphosphate [+F(-)] | cpd:C00068 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.802499229628694 | -9.189228226180493 | -8.632682597555517 | -9.205566908456902 | -9.487703322071335 | -9.769266699899259 | -8.989074836201132 | -9.039446638983513 | -9.712597474666733 | -9.08259541672474 | -8.676794425235 | -8.338382709340385 | -8.244585132389265 | -8.162827607893224 | -8.923811633221705 | -8.3168374332241 | -8.117148073295482 | -8.402377382979493 | -9.490505489070143 | -9.322012030667274 | -8.054529040182754 | -8.154992558993605 | -8.550291856222804 | -8.938301404139871 | -8.808785533100048 | -8.445760895305247 | -9.644623953931326 | -9.35933647191331 | -9.270608391793642 | -9.779268407560796 | -8.545972636520181 | -8.947743253366857 | -9.157854850922876 | -8.838774254864274 | -8.75345358398581 | -8.783085541208935 | -9.568627146874702 | -9.592028113359575 | -8.209984271639538 | -9.158677065718319 | -8.400105533024151 | ||||||||||||
| 455.098 | FMN [-H(+)] | cpd:C00061 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -6.927368954259149 | -7.332244062410523 | -7.332012321056004 | -7.0966107081036025 | -7.1209629093666695 | -6.541083978212408 | -6.719010967964019 | -6.615465410959807 | -6.848004404747059 | -6.917189331945808 | -7.7131292061261245 | -7.488622265858005 | -7.6813464520986745 | -7.732419456261029 | -7.3437443689609845 | -7.926262470380426 | -7.716179576634421 | -7.644599263509369 | -7.851518728685548 | -7.079840623065276 | -7.948544158178449 | -8.041514686679948 | -8.06934987056791 | -8.165279047884024 | -7.222838021871291 | -8.097337022296053 | -7.912464842498175 | -7.522042468828406 | -7.91430658233417 | -7.933081111507543 | -7.058922086324536 | -8.178663541015842 | -7.703178233622157 | -7.8343046545227 | -7.845486204808833 | -7.744361064116481 | -7.585244609899621 | -7.868009889329081 | -7.812762758309381 | -7.87156864374262 | -7.522611760515131 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.565426662767972 | -8.826750990994185 | -8.546507127075577 | -8.061888026357382 | -7.990112934347827 | -7.827815703695902 | -8.009267393459417 | -8.301825035207676 | -8.312372934180095 | -8.269016667214668 | -8.373484456297579 | -8.176593345609547 | -8.130211499459609 | -8.13239277850794 | -8.013244004081816 | -7.966217107581297 | -7.9480124053978765 | -8.196296865014942 | -7.485569092191414 | -7.317908737629729 | -7.81900559728441 | -8.233394071342829 | -7.781536281234825 | -8.25528429501065 | -8.055175884958569 | -7.524389791726746 | -8.379363344580698 | -8.087384969239256 | -8.062770590007426 | -8.05603696850788 | -6.770281058578184 | -8.22598127898155 | -8.171818933578871 | -8.24181806577271 | -8.026234328682174 | -7.201260912510288 | -7.6129651523313395 | -8.02526890393031 | -8.640363921410636 | -7.8475666968743845 | -8.042695436729415 | ||||||||||||
| 455.159 | 5,10-Methenyltetrahydrofolate [-H(+)] | cpd:C00445 | -8.694065323296911 | -8.647384106904273 | -8.680588056472207 | -8.441098019936923 | -8.330858380615854 | -8.065506129509261 | -8.03927146268483 | -7.772521887671136 | -8.472085494953992 | -8.209895795890748 | -8.834937189413113 | -8.196869720703555 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 460.138 | Folate [+F(-)] | cpd:C00504 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -5.469580657890669 | -7.165207714707862 | -7.762619433876229 | -6.402565919156785 | -8.463655762554454 | -8.502915665478985 | -7.895199405808232 | -7.688249603156865 | -7.240739908078528 | -7.438038180331337 | -8.216278342337894 | -8.135890339966302 | -7.880264220031044 | -6.260967443574896 | -6.561884335614249 | -7.763857133439045 | -7.763899311580961 | -7.666321298706825 | -7.7757426365637 | -7.717566851068279 | -7.783589321795949 | -7.794759127276589 | -8.00005297768814 | -8.131335886354949 | -7.810109646387617 | -7.764148549797195 | -7.766665971792262 | -7.635749370335496 | -7.513043514304633 | -7.601561256976984 | -7.5542920643752565 | -7.605352795984044 | -7.63982041289269 | -7.854853265332835 | -7.704970496158288 | -7.605190425281631 | -7.4129750212362024 | -7.603736775281662 | -7.594498581090035 | -8.064657921735122 | -7.6734193532307495 | -8.392327503295814 | -8.2824551703032 | -8.451074815525208 | -8.307138477520612 | -8.494159819544052 | -8.340425776847608 | -8.505035692510297 | -8.62274037603734 | -8.625989423919206 | -8.311728949892704 | -8.4730800728495 | -8.342087337102669 | -8.709429845327893 | -8.274654429676573 | -8.358761298655457 | -9.124137330865933 | -9.159811483008982 | -8.933430156542371 | -8.61766570541753 | -8.422746116873347 | -8.385257614821837 | -8.474682518390413 | -8.391924627554852 | -8.326331155220357 | -8.477960517019811 | -8.522120286160256 | -8.531855240151552 | -8.434590147471727 | -8.245694491156014 | -8.363335645405337 | -8.466095790770956 | -8.342937939830396 | -8.314295785321654 | -8.255176814859725 | -8.601195022448263 | -7.722135007949005 | -8.100706616594339 | -7.804530997059153 | -7.767564809327345 | -7.9542776137201265 | -7.819082903699665 | -7.917515951927051 | -7.800765510974817 | -8.134823766092603 | -7.931639308901764 | -7.864132059467762 | -7.743897383244337 | -7.678025385671231 | -7.743053553050623 | -7.678262549162255 | -7.739180174435898 | -7.68168297070063 | -7.84586031422108 | -7.638756008527705 | -7.761877048555991 | -7.6556959681106385 | -7.7462805011562414 | -7.570471578600836 | -7.673521974352428 | -7.711408601971663 | -7.676926771117453 | -7.833439623052174 | -7.77388276131233 | -7.906877388024693 | -8.037456418243627 | -7.493868025871722 | -7.829659420466325 | -7.896459311813479 | -7.96059137608821 | -7.857615225875943 | -7.841884776209844 | -7.9157763695067915 | -7.821272639208356 | -8.74091952120624 | -8.343739592432064 | -8.63981230694426 | ||||||||||||
| 462.155 | Dihydrofolate [+F(-)] | cpd:C00415 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.182012019755422 | -7.597865530975691 | -6.928974703610428 | -7.55057428282394 | -7.184854473127396 | -7.987949975451703 | -7.640607275396403 | -7.67877336002486 | -7.894254653532465 | -7.420164289748455 | -7.235699071390299 | -7.067852871712466 | -6.88625993054286 | -6.906012890110605 | -7.4983592130485945 | -6.9247395720921 | -6.980394457016893 | -6.802507886002597 | -7.724671234077907 | -7.863359397159037 | -6.864431894657203 | -7.060657144456147 | -7.137063983331201 | -7.528819405773017 | -7.367654300428812 | -7.139729271098396 | -8.137178995212555 | -7.885289886653016 | -7.753997518010538 | -8.114552101146696 | -6.939198194690795 | -7.496043309813829 | -7.603151838725001 | -7.559798268059596 | -7.526243705444134 | -7.418777602645923 | -7.978236315940095 | -7.944652844881505 | -8.111973214352984 | -8.202744325599987 | -8.247675145661992 | ||||||||||||
| 464.167 | Tetrahydrofolate [+F(-)] | cpd:C00101 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.9056348926112445 | -7.617894044285427 | -7.7677426773090374 | -7.6860611119208375 | -7.845903380584716 | -7.453260938176617 | -7.989383746243207 | -8.294067909202996 | -8.135640223563767 | -7.894248128250463 | -7.874021086864845 | -7.861850810632093 | -8.053952044711302 | -7.606111609819002 | -7.489551259301148 | -8.571474165421785 | -8.444711923631377 | -8.42985610863559 | -7.946873058716385 | -7.904435447394157 | -7.958974708311322 | -7.98762897121291 | -8.227237307472388 | -7.837689911466876 | -7.720106942470836 | -8.13417704195064 | -7.885149824747696 | -7.918126821369903 | -7.598536769597856 | -7.778139811218772 | -7.746980993967436 | -7.86053214911484 | -7.588818220064398 | -7.78887879034339 | -7.923063490175614 | -7.418321598079083 | -7.803876088100229 | -7.328952844159099 | -7.49881556475432 | -7.46778033767858 | -7.533573433034162 | -7.59179254421511 | -7.494542834522892 | -7.684869272949104 | -7.460092549118303 | -7.509558068456733 | -7.430531355799879 | -7.3687785447675855 | -7.198068274545784 | -7.653378437843031 | -7.316447181921296 | -7.45726213120302 | -7.395118158975137 | -7.405490568215973 | -7.507393431402509 | -7.338486479026038 | -7.390575382428403 | -7.353361676368859 | -7.6051344003292805 | -7.398629191570149 | -7.175947060082243 | -7.776174040382408 | -7.691349313272853 | -7.756966154852965 | -7.594870428610084 | -6.839479465531174 | -7.544302987894146 | -7.622242809927141 | -7.554608914496294 | -7.73573213476494 | -7.430083620892951 | -7.480433001225429 | -7.472503818513882 | -8.177842119251787 | -8.12685675009277 | -8.166476854115825 | ||||||||||||
| 465.981 | dCTP [-H(+)] | cpd:C00458 | -8.50369833427052 | -8.883983332080483 | -8.862115447747092 | -9.157125469200697 | -9.257267720518668 | -9.175564031033968 | -8.826819701275674 | -8.903958839951276 | -8.685023873643711 | -8.755351683119303 | -9.072838115264906 | -8.88924650411047 | -9.886911939673421 | -10.353490319399898 | -10.468579676069865 | -9.743845217533337 | -9.67083375010324 | -9.104203070659356 | -9.599157865196188 | -9.57582487372943 | -9.368252564463532 | -9.734769317598895 | -9.921998703820796 | -10.854838398761046 | -10.374435827923396 | -10.234023689532467 | -9.987411625004253 | -9.405423687227948 | -9.296283400538982 | -9.387699633046426 | -9.950384892099379 | -9.208792893972898 | -9.7127986113747 | -9.58524320894153 | -9.83366329587179 | -9.68906132679772 | -9.605115102987824 | -10.139656654865558 | -9.628771467832212 | -9.578081531502095 | -10.195534720564083 | -9.244895760390646 | -8.668607289779485 | -9.317606469634885 | -9.347497758161023 | -9.173366175110596 | -9.535711775833436 | -9.488008337816389 | -9.239191581063627 | -9.783397814169467 | -9.107101798891428 | -9.910344635923996 | -9.643577392772318 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.990917481754677 | -10.057069930317356 | -9.622163947310638 | -9.641958341689413 | -9.656109141135222 | -9.673868500932109 | -9.830131228431478 | -9.6445429572813 | -9.87730320983921 | -9.444218812963038 | -9.790571001446148 | -9.721968500480946 | -9.894668156924173 | -9.67863235804435 | -9.694086853513335 | -9.635991669931215 | -9.423589141484433 | -9.533888253828252 | -9.44649499803661 | -9.602712221392403 | -9.208538566510741 | -9.436394713923503 | -9.497158089103507 | -9.828929807410168 | -9.522541487633346 | -9.06383143364841 | -9.976795611207848 | -9.738251147764242 | -9.645891290977605 | -9.764092242654048 | -9.298505143299929 | -9.805645309225245 | -9.87673096230453 | -9.709756226946059 | -9.755181743120476 | -9.002764811227518 | -9.393381108229459 | -9.79821592992507 | -9.661024991220911 | -9.652261538498655 | -9.401464080618592 | ||||||||||||
| 472.154 | 10-Formyltetrahydrofolate [-H(+)] | cpd:C00234 | Folinic acid [-H(+)] | cpd:C03479 | -8.78053481128028 | -8.946042939818659 | -8.890849658823324 | -8.790826302424056 | -8.603627304640453 | -8.520068163655973 | -8.697791063732295 | -8.296483981526217 | -8.757787607573688 | -8.781878966075825 | -9.578560817208727 | -8.7649184426885 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||
| 475.101 | FMN [+F(-)] | cpd:C00061 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.007069888560245 | -8.375202196697892 | -8.780070504512453 | -8.603511950236761 | -8.057961550042192 | -6.810341691895878 | -6.5442695566620115 | -8.83909035713043 | -8.615269569941441 | -7.859949755148415 | -8.850778302029093 | -9.23368161940112 | -9.183270245382387 | -9.07515066432817 | -4.923118247027109 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.440488403895493 | -8.29524788646229 | -8.391886876471776 | -8.398152575792563 | -8.686629154906859 | -8.629648958101882 | -9.02907277598255 | -9.198262434680982 | -9.27385925891831 | -8.95868919893304 | -8.859265810835458 | -8.820672306724335 | -9.783656737364582 | -9.3202243743713 | -9.033109355417604 | -8.77758136748123 | -8.219167322630202 | -8.168481613833313 | -8.82673145464925 | -8.869125240467765 | -8.604516919292479 | -8.738522844544908 | -8.735204908077028 | -8.869137612539475 | -8.841383281605632 | -8.821473731583989 | -8.858701738491195 | -8.94094665495706 | -8.698259916420662 | -8.727213822384682 | -8.748802202455918 | -8.654309277311926 | -8.700478399069164 | -8.865136495698897 | -8.84656217363049 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 475.163 | 5,10-Methenyltetrahydrofolate [+F(-)] | cpd:C00445 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -3.6923355572272416 | -4.208575316374636 | -5.602616950220992 | -4.711786809761015 | -4.45675406681258 | -5.28166694175269 | -5.9302192182451074 | -5.331705498957048 | -5.235551581880728 | -5.924039122780562 | -5.181537868187649 | -5.103703021307727 | -5.309529767665766 | -3.0774163107437764 | -4.229603699255888 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 476.167 | 5,10-Methylenetetrahydrofolate [+F(-)] | cpd:C00143 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -5.809138856183732 | -6.270668691125723 | -7.653232026957415 | -6.59242808663175 | -6.354067104056527 | -7.078885017851039 | -7.68883101475235 | -7.1987747383568115 | -7.11920683850456 | -7.640396460822352 | -6.882253899010297 | -6.955783619875207 | -7.162285349796147 | -5.25148271444532 | -6.258289045116564 | -4.6507452647381164 | -4.587814241129468 | -4.357924344212413 | -4.0012158495090935 | -4.6538347997070195 | -4.314158871660775 | -4.494211765181374 | -5.015363971113678 | -4.628534212766125 | -4.66964268534769 | -4.621174076459519 | -4.119352684835344 | -4.3652148478190655 | -4.209686042971496 | -4.8595062984613 | -3.970982170805792 | -5.1413888110579755 | -4.246043865469601 | -4.7359076242373765 | -4.65505549628103 | -4.404611170109746 | -4.449735816342279 | -4.418193576031637 | -4.507834258096535 | -4.618175619043134 | -4.361786077361221 | -6.751030742801713 | -6.541898306612346 | -6.599804328330355 | -6.271942608671053 | -6.7311520982008135 | -6.3059078636699875 | -7.176751782757232 | -7.341275403580208 | -7.140691368642296 | -7.134703435731274 | -6.870852793425541 | -6.957239219977348 | -7.48430588094009 | -7.0460122620446315 | -6.703124746172662 | -8.578709174755408 | -8.497804451744447 | -8.349120799364945 | -6.563533675493058 | -6.554307256151033 | -6.562580467765063 | -6.779003536508936 | -6.78497786115654 | -6.833036050662297 | -6.676637126323235 | -6.908316401564076 | -6.792895078621256 | -6.7389091865991295 | -6.751246024965453 | -6.724818060151706 | -6.498296545439573 | -6.581420929580399 | -6.471861454524116 | -6.646731129821871 | -6.664624607008204 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 480.983 | dTTP [-H(+)] | cpd:C00459 | -6.302945753591149 | -6.551264258144906 | -6.722100776471579 | -6.568155625196033 | -6.523127060676087 | -6.046514052365699 | -6.101390324463873 | -6.296600624985227 | -6.111233313627773 | -6.173963661388372 | -5.815061343384058 | -6.088918748761107 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.366211146372088 | -8.291840941741775 | -8.419719448863994 | -8.405404330152399 | -8.169272113874648 | -8.463663944770568 | -7.910030861183522 | -8.202171961437548 | -7.9328347626684215 | -8.201904797843927 | -8.347919747574785 | -8.230480208058372 | -7.99827812737896 | -8.245041271137755 | -8.257095744036233 | -7.907801492302717 | -7.868260955862866 | -8.3285274452263 | -7.804462873685948 | -8.178469253287446 | -8.226717932087448 | -8.092784045591218 | -8.273901985955384 | -8.222386218717547 | -7.602322528929839 | -8.157209163516521 | -8.48416301733042 | -8.728252303506778 | -8.67487037265349 | -8.748323875086026 | -8.755567250370472 | -8.5896987017565 | -7.968673111652158 | -7.906639504014229 | -7.842076455085848 | -8.498749727871028 | -8.242153393127932 | -8.240221691916918 | -9.205451282271929 | -9.043726119566507 | -8.780943033346862 | -8.902664709126034 | -8.930289845170615 | -8.976458593945384 | -8.683163264974166 | -8.631246357708449 | -8.676060031772144 | -8.356806199512594 | -8.598089236151361 | -8.632873112168898 | -8.63884645876781 | -8.38912105353407 | -8.58680679153934 | -8.579328692041479 | -8.403918145593229 | -8.714344246039945 | -8.562315878135632 | -8.546245739853513 | -8.551627507480292 | -8.593523771638555 | -8.192315112383557 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 481.978 | CTP [-H(+)] | cpd:C00063 | -6.516774677519894 | -7.233513665420663 | -7.96106701294837 | -7.010286780708791 | -6.860983727859564 | -6.6464072967090235 | -6.805515880955043 | -6.146851406819597 | -5.789908278434405 | -6.159079878081731 | -6.459186873812471 | -6.741292575024107 | -10.048034616993624 | -10.247336158860922 | -10.204359527021497 | -9.628236842022655 | -8.865386189576519 | -7.9841151379301 | -8.75863639558981 | -9.128160066570139 | -8.315237893492688 | -8.768715877270544 | -9.955976000633857 | -10.582762072927979 | -10.425972704333153 | -10.645162606788695 | -10.572241167535942 | -9.900780715855348 | -9.44251706749044 | -10.023272183667961 | -10.352993693208058 | -9.794659571052595 | -9.709558814085947 | -9.315301564902612 | -10.037806581544965 | -9.769242693971307 | -9.716036398054316 | -9.627100581659075 | -9.840668999748539 | -9.753169930174408 | -10.186323419187486 | -9.336589951577524 | -9.004116433870399 | -9.031240659236762 | -9.616294192777975 | -8.976218373534696 | -9.180005080201918 | -9.520840533250476 | -9.226228919017107 | -10.159727704318389 | -9.66794600911814 | -9.48469597603547 | -9.962457139644787 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.60889700488478 | -9.747672690589152 | -9.560697747302768 | -9.434092225972485 | -9.325357176782614 | -9.44749931252892 | -9.517628715811336 | -9.810659215723453 | -9.814452878093714 | -9.543168462123905 | -9.775001328471028 | -9.356877715392004 | -9.408171770848174 | -9.450960552004775 | -9.491549375051699 | -9.556238460941792 | -9.366341978484053 | -9.479005776333173 | -9.213313110324092 | -9.350375262383201 | -9.139156783262461 | -9.431353484525083 | -9.33755242832667 | -9.843787534000015 | -9.262942517222973 | -8.83409096653253 | -9.88349426217484 | -9.557221501802799 | -9.663173820128723 | -9.804490372017721 | -8.530245779441898 | -9.566076654448855 | -9.763610124641646 | -9.461183909368742 | -9.458248323413034 | -8.759817294044085 | -9.51230054113122 | -9.651397367828611 | -9.14408248212786 | -9.10977213410876 | -8.990565541893355 | ||||||||||||
| 482.962 | UTP [-H(+)] | cpd:C00075 | -6.24697934538714 | -7.051482716498322 | -7.9206771938355365 | -7.632202353523469 | -7.582976945144007 | -7.287952188023594 | -7.398480875163656 | -6.937083257147895 | -6.55457393936828 | -6.639796416266721 | -6.87719157046396 | -7.091635711231221 | -10.012699730943355 | -10.102297231018465 | -9.858551176082617 | -9.884563237896316 | -9.235705549362695 | -8.96975831647866 | -8.923024685560137 | -9.459916039850006 | -9.133624314718228 | -8.775900997659207 | -9.620260842069992 | -10.592200955534405 | -10.613422044385313 | -10.925568399642614 | -10.737040847392453 | -9.438551820537434 | -9.092146109361291 | -9.604359946801347 | -10.048114940382675 | -9.379171730755141 | -9.532754369299981 | -9.317721791993636 | -9.890177655996728 | -9.440376114484206 | -9.577168944680018 | -9.670829925588308 | -9.648139592395566 | -9.510214886596478 | -9.645681293351565 | -9.175058790807645 | -9.117059464258002 | -9.101198448487638 | -9.420870882306206 | -8.944232597560877 | -9.47291040082432 | -9.280014467701232 | -9.104374793135039 | -9.766272046767561 | -9.455958931204382 | -9.529018263891752 | -9.965889817413752 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.779255457536214 | -10.048565630332334 | -9.771295191107617 | -9.875710865683345 | -9.380439361869989 | -9.690956639475225 | -9.611799805089252 | -9.721114337894518 | -9.890060792953964 | -9.547874871595415 | -9.859174545214692 | -9.620970905429143 | -10.000091146117779 | -9.783430023220498 | -9.880615514917208 | -9.712488022119489 | -9.656856272004145 | -9.779044487887463 | -9.068004827400403 | -9.574783042086553 | -9.52577565785458 | -9.74318175852257 | -9.50334009005376 | -10.159545062515098 | -9.750436681802249 | -9.350790515962752 | -10.136490906843152 | -9.894303950687465 | -9.95738910972613 | -10.013195793887853 | -8.878200916867893 | -9.707677086758547 | -10.013986868642569 | -9.640957970785909 | -9.936609562865996 | -9.091903615173962 | -9.814376743179194 | -9.97633770091413 | -9.784878889761641 | -9.646602646375205 | -9.621185364627712 | ||||||||||||
| 487.1 | CDP-choline [-H(+)] | cpd:C00307 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -10.40529636934658 | -10.63052564124161 | -10.515967006971431 | -10.28348901269977 | -9.984994761686043 | -9.549230447762064 | -9.223551012561868 | -10.46080381036313 | -10.336437819314838 | -9.738447610263151 | -10.066870047633664 | -10.347763716661278 | -10.630216922278409 | -10.670334074300944 | -10.166288237647553 | -8.68315216425333 | -8.497814003990824 | -8.539682584914653 | -8.89852318834105 | -8.398663923592212 | -8.732472766730803 | -8.396518418214274 | -8.603819377638011 | -8.83044346749386 | -8.695703643416813 | -8.812092142783275 | -8.649021942183085 | -8.536767447861743 | -8.699060006330559 | -8.111511843038388 | -8.066236106149761 | -8.344087102013106 | -8.82520425474361 | -8.336184366062511 | -8.53634171849616 | -8.54592105991598 | -8.463235576420505 | -8.750296986487571 | -8.272921643389196 | -8.840769222248552 | -8.425605192515492 | -8.731575676486269 | -8.505897699572103 | -8.722897227340791 | -9.345848629797059 | -9.80201438412973 | -9.742545219050328 | -9.696156172251515 | -10.00540904439879 | -9.91322469734206 | -9.632890095822404 | -9.58395268962791 | -9.906741835138636 | -10.160005495824748 | -10.106212422553693 | -9.998348497720091 | -9.100299872533247 | -8.95775653284601 | -8.788611466762628 | -9.7996193088235 | -9.824913215380478 | -10.09616848853281 | -9.861096490647808 | -9.839315318723326 | -9.56323772794346 | -9.585613634882186 | -9.801875732418033 | -9.713461463449278 | -9.646684369777601 | -9.716360002389399 | -9.783821361326062 | -9.711365553694275 | -9.643878878282324 | -9.645807556013951 | -9.80882467434816 | -9.74097386094548 | -8.199877332401892 | -8.606192772300927 | -8.003449744571732 | -8.43719687358362 | -8.55599851880915 | -8.573947905631087 | -8.31171651716727 | -8.344643421990884 | -8.7020406058335 | -8.448808820007773 | -8.091666563514275 | -7.984632833745475 | -7.773631499079282 | -7.806001655434527 | -8.094022167693762 | -7.831078958332592 | -7.657923157945347 | -7.708477399986105 | -8.660202598516983 | -8.706228103829101 | -7.784293454144374 | -7.910926774269313 | -8.157801257513555 | -8.345923367698854 | -8.232651031720762 | -8.027965856067325 | -8.843341026215713 | -8.657272982712762 | -8.510854231893305 | -8.928676834198635 | -7.779041796210897 | -8.180430928788226 | -8.36450291084652 | -8.186517487583432 | -8.29301104359691 | -7.950834634753483 | -8.879634620437141 | -8.886714000050144 | -7.962061876701882 | -8.194326220221091 | -8.115788953828043 | ||||||||||||
| 489.993 | dATP [-H(+)] | cpd:C00131 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -10.506143786874294 | -10.820976504880473 | -10.578441763787302 | -10.12522914881287 | -9.501897554178207 | -9.174970344743388 | -9.529367044132908 | -9.643669951290716 | -9.382620698220606 | -9.980290211362561 | -9.86162675560165 | -10.78386719621607 | -10.09960056383077 | -10.745693189491101 | -10.862604535591682 | -7.6061415355972235 | -7.538234466288849 | -7.330277727848907 | -8.868626511692435 | -7.270151519714451 | -8.186704697528 | -8.100686633952957 | -7.963230794532859 | -8.17839392655254 | -8.151052276834873 | -9.638094085196721 | -8.147292362449287 | -7.371604714236358 | -8.460214663140158 | -7.533774386266943 | -6.520206658067 | -7.916592440968152 | -7.763326372670531 | -7.802294318488179 | -8.155711536504807 | -7.572487015440089 | -8.06860554808592 | -8.22523116124932 | -7.148334415640077 | -7.988346094065404 | -7.659431415476406 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.697690283206557 | -9.919244605129128 | -9.79031021654801 | -8.349887766922574 | -8.515846980455098 | -8.522464710943574 | -8.244055038171561 | -8.396115673534297 | -8.811035755090053 | -8.443097901716376 | -8.29223847944934 | -8.4920128800051 | -8.611007874159665 | -8.84418389901102 | -8.114902314790289 | -8.54444305048886 | -8.215784171144543 | -8.369218308279796 | -7.952166302499107 | -8.004754468245775 | -8.414408239640014 | -8.348706102936601 | -8.189295290889744 | -8.755502044203833 | -8.273354298554459 | -7.96327500268637 | -8.645122044814169 | -8.816175094292573 | -8.707359351174155 | -8.658544015829975 | -8.392293446938982 | -8.808779697488367 | -8.66887551427432 | -8.705939807170525 | -8.5884366985814 | -8.039111502619603 | -7.758547861287836 | -8.54968670185461 | -8.767751231918657 | -8.651337416334906 | -8.639529162830836 | ||||||||||||
| 492.163 | 10-Formyltetrahydrofolate [+F(-)] | cpd:C00234 | Folinic acid [+F(-)] | cpd:C03479 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -7.0591206160157025 | -7.58369769203012 | -6.821155898395677 | -7.269017133989063 | -7.605716661891153 | -7.690350433686163 | -7.377581223633491 | -7.476067658105772 | -7.884335018440791 | -7.25595274691245 | -6.965198161336235 | -6.86531724698054 | -6.646412014058834 | -6.6481643372452845 | -7.222483055739207 | -6.77512374338012 | -6.9180319020253735 | -6.674711717811007 | -7.516219558170819 | -7.569959875670715 | -6.712720795977689 | -6.616002648430243 | -6.717203683402619 | -7.040157212827656 | -7.128819691509742 | -7.025797908735146 | -7.976974244109641 | -7.660267655705951 | -7.578846910995937 | -7.968765587854817 | -6.850248941944296 | -7.3325552234263105 | -7.449598247704 | -7.440222412237893 | -7.264982761016784 | -7.240915295340167 | -7.529447925165553 | -7.566092104483275 | -8.219358299918195 | -8.153005752287937 | -8.397001689314381 | ||||||||||
| 500.99 | dTTP [+F(-)] | cpd:C00459 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.75387599661538 | -10.060606851336317 | -9.786590086197199 | -9.40160055201637 | -9.780369657102048 | -9.824651472520195 | -10.112732696876822 | -10.015046067497163 | -8.971415302885726 | -9.948898569475569 | -9.489085887500911 | -9.852463697143852 | -9.640109576899171 | -10.124549164125524 | -10.084943233137814 | -8.908475513023827 | -8.980463489662924 | -8.632867058352826 | -9.029273009147492 | -8.721874864570953 | -9.091419235406796 | -8.87797634102917 | -8.877841584345438 | -8.91491486560629 | -9.123096676701781 | -9.470766376483605 | -8.764727724405102 | -8.548051283025442 | -8.675426145870116 | -9.349309318654754 | -8.74615342004483 | -9.45856448866358 | -8.724831057467872 | -8.87993261130641 | -9.021855263520642 | -9.014060246497273 | -9.401716724353308 | -8.787290444516815 | -9.010576387717515 | -8.521974233953417 | -9.055193449491 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 501.978 | CTP [+F(-)] | cpd:C00063 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.597701490615487 | -9.690819497807317 | -9.575568152492815 | -9.391527985701536 | -9.402350154160557 | -9.308704433418878 | -9.500108422452211 | -9.584663147309138 | -9.556354149507506 | -9.503189115443499 | -9.478425114570168 | -9.404659999297321 | -9.580387272530523 | -9.484194449397599 | -9.45089245985832 | -9.454096922011846 | -9.2995915749962 | -9.570685773473482 | -9.020478194046623 | -9.185284837330254 | -9.126541625187802 | -9.363185058072014 | -9.261930283082615 | -9.656371272737147 | -9.215328040439044 | -9.089576799760263 | -9.578243137203868 | -9.549047692834717 | -9.707282192694896 | -9.421573167437321 | -8.847747835081407 | -9.60775044819697 | -9.547406585846332 | -9.673913116601284 | -9.328807350161469 | -9.165906655402173 | -9.282021440988688 | -9.170581280367415 | -9.549187673915172 | -9.690592128420494 | -9.426431269279915 | ||||||||||||
| 502.967 | UTP [+F(-)] | cpd:C00075 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.929468619780586 | -9.952369866129873 | -10.279530680019347 | -10.29884653539303 | -9.977072556110016 | -9.757305709151177 | -9.882434520714861 | -9.87881919499936 | -9.885053161347786 | -9.999111936559983 | -9.794722358864817 | -10.328607161310114 | -10.366384989545699 | -10.383137382647787 | -10.371878519436654 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.043327118555508 | -8.95922940830243 | -9.099597575523427 | -9.183736905143393 | -8.569650959538611 | -8.676555156012727 | -8.969438925307871 | -9.054668876495613 | -8.748328298510964 | -8.814450525567146 | -9.277827135183541 | -9.137412064573232 | -9.31167557233924 | -9.129456953533547 | -9.109565881984443 | -9.072652948841478 | -8.985258318182343 | -9.16570548420551 | -8.539260823654319 | -8.982728840453388 | -9.239059444097869 | -9.05768665989262 | -9.342999975306777 | -9.239317497607368 | -8.957503926679564 | -9.030612661985579 | -8.921692239889063 | -9.158316769261353 | -8.825287052258496 | -8.64746526213041 | -8.677981776492514 | -8.804777167660545 | -8.947776951914967 | -9.103859708549184 | -8.845052476963476 | -8.693046374298364 | -9.210724822697143 | -8.848616400616619 | -9.004736304573813 | -8.622641573600607 | -8.88789762993048 | ||||||||||||
| 505.991 | ATP [-H(+)] | cpd:C00002 | dGTP [-H(+)] | cpd:C00286 | -4.263688654330831 | -5.1493782683301585 | -6.314598485621372 | -5.152258049264004 | -4.90704970076973 | -4.606318652834038 | -5.045897540570432 | -4.326765406509182 | -3.8776055652346617 | -4.295936313538081 | -4.530095608623073 | -4.813775224070409 | -9.392225145704973 | -9.76883304266379 | -9.91939656297384 | -9.253739579146576 | -8.733956235589764 | -8.099712849439321 | -8.732295762765354 | -8.668132574165153 | -8.260852990586292 | -8.831930322461105 | -9.057781388052991 | -9.359415680100668 | -9.722570499573052 | -9.667533622208978 | -9.815841684357128 | -7.787598397619505 | -7.7816985814137745 | -8.208436283600276 | -9.228056228448658 | -8.057710480343234 | -8.428608753158423 | -8.02525279063548 | -8.795398521546526 | -8.341660999202912 | -8.268699982312082 | -9.132234288753043 | -8.820892492950147 | -8.234128280541482 | -8.888909043769019 | -7.292492117133156 | -7.003451066430595 | -7.018673816813902 | -8.169155498911506 | -7.386287861254954 | -7.74497872139089 | -7.631098480055511 | -7.62262387192559 | -8.284817428609397 | -7.951128718307245 | -8.648023718739328 | -8.192839878295025 | -9.161350487121348 | -10.583564879423857 | -10.77310357144068 | -10.624866185242276 | -10.17455755519974 | -10.845613462670572 | -8.760184037979611 | -8.178419719652242 | -8.189920998648788 | -10.357791959016275 | -10.102885812068108 | -9.876938167168543 | -11.198519489383974 | -10.9493250737717 | -10.102407643512926 | -11.351483391231561 | -11.442174485700889 | -11.37436321465654 | -10.031665501862266 | -9.334259554017693 | -10.051715204405596 | -9.377381365084053 | -9.376875510897557 | -9.253318032672375 | -10.07808665286985 | -9.160109607223255 | -10.101145766091703 | -9.547286727126753 | -10.136084226588432 | -10.08401215654482 | -10.014207059549085 | -9.580673144660338 | -10.33561907792999 | -10.196948444841178 | -10.221800488422664 | -9.581849956191103 | -9.77599471982026 | -9.651581590960458 | -9.01410626431834 | -8.994987005339215 | -8.946028351604593 | -8.563378413778878 | -8.717408277152622 | -8.973212092684363 | -8.926600545324373 | -8.89154833933958 | -8.95093278425547 | -9.07812642164099 | -9.079768252726588 | -9.029247134500963 | -8.795754054770336 | -8.779208517489582 | -8.990749248203505 | -8.005678374014115 | -8.552097614434645 | -8.673801943503573 | -8.75757520981395 | -8.825325095558773 | -9.531283699408567 | -8.745026662057779 | -8.538137304618955 | -9.41700135048245 | -9.160430531230563 | -9.019920880972403 | -8.912788412981673 | -8.10018330956383 | -8.984969862912092 | -9.31059245364989 | -8.875258714536095 | -8.909295460977535 | -8.287637956286707 | -8.373700105030375 | -9.271293557589477 | -9.11969497969754 | -9.023263430401364 | -8.783889717764664 | ||||||||||
| 507.102 | CDP-choline [+F(-)] | cpd:C00307 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.121257833800634 | -8.982646600822935 | -9.035601611385585 | -9.154613215476704 | -9.140598694535337 | -9.123951335003246 | -8.8022999548516 | -8.920941554027097 | -9.218693448729853 | -9.101289930356181 | -9.230926961712813 | -8.970163769555649 | -8.94444860311799 | -9.188990954202925 | -8.664491820438155 | -8.465879628063444 | -8.807116903819987 | -9.1663056047903 | -8.847524881244205 | -8.893951535193812 | -9.037945478827526 | -8.75936589001069 | -9.171946119436448 | -8.772017470565938 | -9.167440318467941 | -8.950254048560053 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 510.004 | dATP [+F(-)] | cpd:C00131 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.658375312307824 | -9.806201869642397 | -9.725953945023996 | -9.684768794101025 | -9.819016798470926 | -9.713590433628521 | -9.809805714433365 | -9.758794790004336 | -10.079388362396207 | -9.827067846955588 | -9.692462236524525 | -9.416893716990668 | -9.36870884016171 | -9.513143349007409 | -9.403223858278905 | -9.714319819966684 | -9.204248228350055 | -9.49520353388623 | -9.654490604558822 | -9.680822385497903 | -9.397087518668037 | -9.352465943306811 | -9.53973128227234 | -9.583568675863127 | -9.510222912903838 | -9.414763918948646 | -9.81600038454544 | -9.672117612182214 | -9.574785423456289 | -9.785913955616532 | -9.193963612990416 | -9.547113623225338 | -9.83182688108149 | -9.573626793839198 | -9.468990800462764 | -9.429681740556987 | -9.72702929984433 | -9.634478357543976 | -9.113705510391956 | -9.68476293705659 | -9.192774180888902 | ||||||||||||
| 521.983 | GTP [-H(+)] | cpd:C00044 | -7.781949933266725 | -8.21644209501489 | -8.484926582783991 | -8.135597877151037 | -8.092803326242418 | -8.02959511582663 | -8.129358379524934 | -8.138502994957395 | -7.869522073423364 | -8.113373133512901 | -8.085506789308658 | -7.925682743587612 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.697075693205651 | -9.425506385096673 | -9.787567285781403 | -10.236270138421956 | -9.586773141365358 | -9.90211472900115 | -9.749787316850945 | -10.132299449864027 | -10.041694662372453 | -9.772437399866586 | -9.854955950691362 | -10.213022405658387 | -9.710057507764919 | -10.17764445460264 | -9.372366525047944 | -9.263165906881651 | -9.271886242681207 | -10.006181020225894 | -9.365087580741491 | -9.647451666985654 | -9.644937589239948 | -9.603994884673453 | -10.181443021005188 | -9.863185678468916 | -9.971053563013916 | -9.956286929337143 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.994056926747591 | -9.216663042066266 | -9.514513924670888 | -9.328458065200339 | -8.913836771109503 | -9.158667229107547 | -9.125720070841963 | -9.137586338493367 | -9.266635444628687 | -9.242602735511158 | -8.860667221125986 | -9.41150623258997 | -9.370067754857644 | -9.194563591966181 | -9.397949403799368 | -9.243837313524422 | -8.995106575358484 | -9.080742750102043 | -8.571971515227576 | -9.306813570140378 | -8.78817221859436 | -9.152015673655242 | -9.014401112808823 | -9.56992447395861 | -9.127085296083521 | -8.97461148556011 | -9.547679101866553 | -9.517533608160042 | -9.029888549051062 | -9.382703329887049 | -7.9922235256305525 | -8.875293460586485 | -9.30306543135297 | -9.150650424783322 | -8.806242623004264 | -8.828445775163765 | -9.303950380799803 | -9.276621091542587 | -7.9463481127104085 | -8.200316395423012 | -8.886217191115136 | ||||||||||||
| 525.996 | ATP [+F(-)] | cpd:C00002 | dGTP [+F(-)] | cpd:C00286 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.935249369758667 | -9.841214963475881 | -9.722506491221413 | -9.757064706938168 | -9.384005507206268 | -9.562088864215514 | -9.752846275942202 | -9.78028496132068 | -10.004330594995666 | -9.78452548608438 | -9.921257953304531 | -9.600719783337027 | -9.577782873087358 | -9.49665613241907 | -9.682866854624615 | -9.646266679852728 | -9.479842440008586 | -9.680504189886838 | -9.39162297619222 | -9.70643322516088 | -9.211049500092075 | -9.53078237935435 | -9.499783828674238 | -9.737084134682862 | -9.516405297377654 | -9.221990177841327 | -9.603026682595544 | -9.803005651096758 | -9.805152702742845 | -9.758562096027944 | -9.038966337443295 | -9.647080568721478 | -9.609540292091939 | -9.656504810072972 | -9.85920398464426 | -9.35136299529618 | -9.84861962603118 | -9.866432597267233 | -9.379812187055176 | -9.555373317663038 | -9.379281246848347 | ||||||||||
| 565.048 | UDP-glucose [-H(+)] | cpd:C00029 | UDP-alpha-D-galactose [-H(+)] | cpd:C00052 | -6.506839421115218 | -6.309382635440274 | -6.2445350083566735 | -7.434890014227905 | -7.900208617992605 | -7.671314365330066 | -7.348941987823982 | -7.396511897568332 | -7.459972073438419 | -7.87689829763316 | -7.447081716253037 | -7.967152050227876 | -6.750892679890384 | -7.86036691032541 | -6.733799383959954 | -6.825129046714027 | -7.24373060020048 | -6.47777670482586 | -5.670535182448087 | -6.646635376013718 | -6.510859066849637 | -5.567930948839107 | -6.322932412772458 | -6.650122562063194 | -7.379473604669759 | -7.2423730824779815 | -6.385219702360273 | -6.06218856457092 | -5.691173165638374 | -6.854245789738239 | -8.239055201361985 | -6.627985574118787 | -6.015774341711819 | -6.178500185569581 | -6.270172471704343 | -7.022590929736511 | -6.3888243062201395 | -6.674183813465945 | -6.967080291577152 | -6.554770885481598 | -7.3377433551067535 | -6.320077009781079 | -6.2118521659060635 | -5.895804985030153 | -7.415477961926468 | -6.730029972673146 | -6.588067481492852 | -7.042288122414439 | -6.4456091305298555 | -7.7152704091911 | -5.739131232366439 | -6.864245194031421 | -6.131271588178076 | -6.685775210930565 | -7.083113042294486 | -7.160967309028009 | -7.9958180181385075 | -8.10812595512502 | -8.935110598352745 | -6.105598322051128 | -6.2837845604826414 | -6.21570345870223 | -7.971514593121683 | -8.126420019601754 | -7.885469624162384 | -7.732560495526106 | -7.194988291302878 | -6.787177392235824 | -8.907327189757865 | -8.535182417264402 | -8.64491271315629 | -6.505274670319082 | -6.243032484023173 | -6.959243334491332 | -6.534362993082715 | -5.641128645660655 | -6.335164132257438 | -6.741564790815336 | -5.990891404000416 | -6.978991451411085 | -6.462339141923222 | -7.372850250310186 | -6.469886079479972 | -6.587670397158736 | -6.2801040146976606 | -7.453296073688505 | -7.202117405663554 | -6.82985452166545 | -8.806554356014171 | -9.204335981416031 | -9.184918006972083 | -7.428404383539376 | -7.626881631401966 | -7.99131827785412 | -6.224004753522097 | -6.42854564986761 | -6.752905583763847 | -7.467798264574181 | -7.129445613028915 | -7.069521056256354 | -6.578759914930448 | -6.408611216915218 | -6.471993526555764 | -6.0729505967236985 | -5.94490656556123 | -6.178696140776684 | -5.706449102698469 | -5.640195751304223 | -5.2625063969980665 | -6.554452912475605 | -6.393860713180932 | -7.176981399870946 | -6.633297971117986 | -5.504151546306538 | -7.676132675173993 | -6.895521283679806 | -7.195414728222662 | -7.158694359958928 | -7.122239106288093 | -6.9484072236242005 | -6.963838681229577 | -7.067326568507073 | -7.021502820185145 | -6.15276007559702 | -6.681576128299185 | -7.322168823731548 | -7.551807908444041 | -7.321801923112358 | -7.394331700936932 | ||||||||||
| 601.951 | Guanosine 3',5'-bis(diphosphate) [-H(+)] | cpd:C01228 | -11.101366146380668 | -10.866883887385002 | -10.643135902862475 | -10.723036586937708 | -10.783578407799245 | -10.618479704420189 | -10.679752382166722 | -10.018530135059608 | -10.66663328051681 | -10.379148531006138 | -10.483946787734626 | -10.61483377066806 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 657.094 | Cyclic di-3',5'-adenylate [-H(+)] | cpd:C20565 | -9.268363753684564 | -9.021910592055676 | -8.983684967700416 | -9.11703762541819 | -8.909992758366547 | -8.697067107166216 | -8.857289904290239 | -8.7896732881073 | -8.957309774041775 | -8.984686282815584 | -9.328937145973311 | -8.952689745098253 | -10.268383183941472 | -10.972732452632005 | -10.278777050090547 | -10.584864928981224 | -10.4581897507464 | -10.279156667421653 | -10.626547876145706 | -10.46082061900333 | -10.458082240716873 | -10.548382287399457 | -10.130524455007873 | -9.71690057522256 | -10.347317822110744 | -10.681912707699272 | -10.253925643778883 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 664.096 | Deamino-NAD+ [-H(+)] | cpd:C00857 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.94155964124464 | -10.68874527211011 | -10.353745264481859 | -10.362702372709995 | -10.36848143329596 | -9.756388012700242 | -9.669731325881843 | -10.635878734593225 | -10.323493635346704 | -9.498604992846369 | -10.065787879964383 | -9.860296907701386 | -10.828102078803624 | -10.98641435133542 | -10.269238556173727 | -9.826723058893704 | -9.389557961923282 | -9.75180493889609 | -11.199238402182747 | -9.838720496045434 | -9.87998275685632 | -9.657804417674134 | -9.727906493610627 | -10.044743924819787 | -9.783763301952353 | -9.746667784702511 | -10.269255036648554 | -9.828255006995228 | -10.806286253251493 | -9.3921814162419 | -8.965514604294937 | -9.214194576779384 | -10.634327493888106 | -9.623436764745517 | -9.86024693850349 | -9.777359803577202 | -9.444661288432767 | -9.964662239171096 | -9.465257083912354 | -10.016836679148913 | -9.710033797940667 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.980390396700578 | -9.48873658357282 | -9.091959575377494 | -8.870356063811535 | -8.890770441441063 | -9.175084764233866 | -8.945397683055305 | -9.002985223654658 | -9.237967625730965 | -9.066715238163468 | -9.018093258108097 | -9.051630313554632 | -8.819417409949454 | -8.876587276748522 | -8.86598912212246 | -8.787086653194992 | -8.69688681645209 | -8.6419662453856 | -8.890170562985658 | -8.900840688462965 | -8.41250867145247 | -8.803117861079155 | -8.652758264192467 | -8.931192144770616 | -8.81481870191338 | -8.351165441744989 | -9.169058166815288 | -8.86726601767194 | -9.031167648262052 | -9.225565657318738 | -8.674619069191227 | -8.830466739264832 | -8.787752237005165 | -8.964301165405912 | -8.769485543989585 | -8.704271199971593 | -8.904881397389131 | -9.015734249967785 | -9.327387474066823 | -9.0278242378233 | -9.115593320022347 | ||||||||||||
| 677.1 | Cyclic di-3',5'-adenylate [+F(-)] | cpd:C20565 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.47711440827958 | -9.301539764347606 | -9.260526330492754 | -8.948138327938366 | -8.714005552435236 | -9.471217504688296 | -9.423272149760798 | -9.22290472466758 | -9.299964831825807 | -9.447940000418718 | -9.457670471484725 | -8.902204087761676 | -8.664363057230116 | -8.644196167779489 | -9.711016974531193 | -9.097479844136739 | -9.550648746430857 | -9.138430115329841 | -9.296358622032903 | -9.2825978235543 | -9.466194278321536 | -9.741080862610358 | -9.033496731609642 | -9.341578047319402 | -9.267114359792558 | -8.831558474337958 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||
| 684.097 | Deamino-NAD+ [+F(-)] | cpd:C00857 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.049380384836102 | -9.515789933268602 | -9.316457680305298 | -8.886156119674945 | -9.060758968396128 | -9.208491468297751 | -8.996164966360617 | -9.221683939086146 | -9.15612233143069 | -9.177959236458506 | -9.15262292334036 | -9.01412613712243 | -8.854158879519193 | -8.908912857866081 | -9.08695463232673 | -8.693768684412236 | -8.763274344592674 | -8.928025057021149 | -8.805327655716068 | -9.003415004677857 | -8.417096942833476 | -8.653892077459576 | -8.766545434705257 | -9.101622176025662 | -8.934350552939645 | -8.446036951212413 | -9.289701374200074 | -9.17654297661458 | -9.111614551927753 | -9.27711069352342 | -8.863211537785334 | -8.846589194283673 | -8.965715492600406 | -9.118622673590966 | -8.736318211753572 | -8.444646086134872 | -9.080212949565352 | -9.145020260466392 | -9.401612527133427 | -9.002640492769887 | -8.950262690709106 | ||||||||||||
| 686.144 | Dephospho-CoA [-H(+)] | cpd:C00882 | -10.8776399121941 | -10.615009873480568 | -10.122969620322683 | -10.487987663814334 | -10.266726096309451 | -10.108945506171628 | -10.168858797854035 | -9.62989872398862 | -10.2749841977324 | -10.179266377219252 | -10.737811756158914 | -10.345235786116028 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.16690495431929 | -7.9708783708078315 | -8.873298877466965 | -8.061869960681674 | -7.797660377185742 | -8.910055385050967 | -8.533334559835259 | -8.864151688378067 | -8.875292434931444 | -8.614966848632303 | -9.01443632422893 | -8.71014508242803 | -9.203302085806621 | -8.30843509390929 | -9.133677319221862 | -8.672145101241107 | -7.505868225770142 | -7.664789574659482 | -7.360572489624074 | -7.495171208777225 | -7.412518056022828 | -8.104475670914296 | -7.67760689348423 | -7.947842795492656 | -7.941737546177863 | -7.910151237545777 | -7.719297183342155 | -7.241730851090887 | -8.471536790471257 | -7.74119036001946 | -8.055893888530376 | -7.985807755369782 | -8.2107861093449 | -8.186563178953662 | -8.256351362321121 | -7.9129284164853395 | -8.493416088415186 | -7.813738035359573 | -8.333799289297056 | -8.897241245866244 | -8.924323741204844 | -8.104429804904862 | -8.18651565782436 | -8.621566687358731 | -8.125098787244161 | -7.8950915088505 | -7.785446530201862 | -7.5043054100035524 | -7.709176217636349 | -8.02245541572456 | -7.5838837403945485 | -7.600292507615697 | -7.5530437612895724 | -8.685990874102192 | -8.384786681673488 | -7.528898339083194 | -7.6088575083028624 | -7.849993422642542 | -8.03912884402507 | -8.067085742179271 | -7.707064952689574 | -8.680833107261737 | -8.393912242560367 | -8.344262036278103 | -8.891469835456803 | -8.331846842067655 | -8.010759763394473 | -8.193959268821395 | -8.066145988976185 | -8.021590161696043 | -8.161879584467158 | -8.800396755400504 | -8.644424392111521 | -7.8499907548784345 | -8.347843729119061 | -8.100792049632096 | ||||||||||||
| 743.08 | NADP+ [-H(+)] | cpd:C00006 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.850925739851446 | -8.929932089154015 | -8.996295742722465 | -8.914215427825269 | -8.480988106941567 | -8.669908747080312 | -9.103421217944984 | -8.851456877238435 | -8.572081042708524 | -8.563761911660785 | -9.047735436837586 | -9.046260556876948 | -8.99437501139132 | -8.886833829901617 | -9.003505114778676 | -8.769314828452613 | -9.120624103037075 | -9.02248002874177 | -8.379611018570795 | -8.724481530147793 | -8.834974648982021 | -8.945182589174383 | -8.980489742800247 | -9.145270577750976 | -8.78521309968389 | -8.821354025053646 | -8.767745224902196 | -8.924790261069607 | -8.839068230612906 | -8.654067398736535 | -8.518733808837974 | -8.712613374603949 | -8.8851415160175 | -8.973401123869019 | -8.907769317935365 | -8.723620711843624 | -8.79408407522469 | -8.619781717308951 | -9.409760642069845 | -8.613719594290519 | -8.918878717414579 | ||||||||||||
| 766.11 | CoA [-H(+)] | cpd:C00010 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.994822707264056 | -9.46234720330677 | -9.811748826543049 | -11.205296593483883 | -9.61152300299723 | -10.216977863566502 | -9.62132537209352 | -9.45456838843945 | -10.144051739918394 | -9.81038312633066 | -9.751718381229201 | -10.382740064378368 | -9.826762094586682 | -11.191894188473805 | -8.671354484961912 | -8.450622813206467 | -8.700244604838751 | -10.819130542197847 | -9.606568645215539 | -9.336095565995793 | -9.913534167081831 | -9.552015669848089 | -10.123815403021448 | -8.814380764672869 | -10.47651183149508 | -9.991227546595686 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.728993523576722 | -9.172974026872069 | -8.818617129563462 | -8.239151805658908 | -8.966990156264961 | -9.030720788194673 | -7.9713770405864945 | -8.033567902986002 | -8.924453658954558 | -8.282866352527403 | -7.77102499129679 | -7.6121442114148605 | -7.7692869265072275 | -7.670919834515833 | -8.048862797515248 | -7.559561371392528 | -7.415861357808087 | -7.550913109923146 | -8.396324285198517 | -8.23007696019795 | -7.081035072081812 | -7.612652955609306 | -7.7275942212842015 | -8.408006255122624 | -8.080297296259689 | -7.523167858693729 | -8.948756465674942 | -8.509565692141422 | -8.30262047693086 | -8.666870752293233 | -8.183470044440956 | -8.105633779255102 | -8.288739577753708 | -8.080449129762536 | -8.035390623085911 | -7.832816728418043 | -8.637120454788102 | -8.69329978706665 | -8.843800565012275 | -8.733805008698605 | -8.76142140063345 | ||||||||||||
| 784.15 | FAD [-H(+)] | cpd:C00016 | -9.346384731036556 | -8.370836476074667 | -8.78298313089191 | -9.661450872790741 | -9.50455505832246 | -9.523699018912955 | -8.314446707682793 | -8.637311566990784 | -8.618144060569264 | -8.367055693119633 | -8.159646165047375 | -8.659463449484551 | -9.905485143385055 | -11.52669394519938 | -10.26019862531377 | -10.321151924671344 | -11.607175476401482 | -10.651683587830952 | -9.38243874480039 | -10.437426020073305 | -10.557540881038873 | -9.347389618767178 | -12.535029938995478 | -10.587452548675582 | -11.756898143904554 | -11.811666659506121 | -10.253499026882778 | -9.17850589923849 | -9.986114624648417 | -9.289544310522759 | -10.273918577024904 | -10.125959635951633 | -9.53321451664821 | -9.580259349350145 | -9.739946561290278 | -9.83797559040804 | -9.87100643694307 | -9.533010441683116 | -9.98451610772777 | -10.015853489408105 | -10.505426198860567 | -8.783733849292574 | -9.025560085720574 | -8.850581216806725 | -9.601867508655083 | -8.986644919217365 | -9.429218789720945 | -9.758578932842111 | -9.193600457402372 | -10.060313594277936 | -9.641881952124178 | -10.516240516300769 | -9.79631206691812 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -8.482929219058404 | -8.922709730145215 | -8.796031945153311 | -8.617222576909713 | -8.659560171097809 | -8.87557213884408 | -8.270400713622237 | -8.412200284544177 | -8.693978463694236 | -8.503204426959382 | -8.550117732251293 | -8.502809634098462 | -8.416987039519157 | -8.285718078224214 | -8.49189952480915 | -8.07686701264269 | -8.263718209266576 | -8.301040134897308 | -8.172755426840757 | -8.20204435964903 | -7.9617813125458845 | -8.356304895281497 | -8.295055206305038 | -8.47455214037475 | -8.412868286810587 | -8.217868747791615 | -8.803702295578546 | -8.513740928027039 | -8.559630663560196 | -8.613089030245398 | -8.356477090990646 | -8.499151875977397 | -8.46435793707481 | -8.662111843352411 | -8.507164929971175 | -8.177006964108674 | -8.244339890942824 | -8.52469685805693 | -8.858325521630546 | -8.52036342545297 | -8.705610922713404 | ||||||||||||
| 808.118 | Acetyl-CoA [-H(+)] | cpd:C00024 | -10.187347064264632 | -10.062155188468315 | -10.334321847880236 | -10.089110657884175 | -10.047969710936588 | -9.888180011238019 | -9.596764186779055 | -9.878731996240859 | -9.572153921110955 | -9.987127032828816 | -9.887272660763003 | -9.990569567289661 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.894186320307027 | -9.31715955812083 | -9.837923283716831 | -20.83601369570085 | -9.263786206752359 | -10.033946895406803 | -10.113094693076373 | -9.809215961285071 | -9.558073750323842 | -9.046240499992827 | -10.074003961944078 | -11.45917216239854 | -10.107464521131398 | -11.704078493559887 | -9.167582071599869 | -7.748398084056226 | -8.791429805844299 | -11.159772181537251 | -9.188557536996495 | -9.527228712502692 | -10.052210544436866 | -9.031858242381865 | -10.904933572936319 | -9.41605784364226 | -10.531494484001346 | -9.978648762346403 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -9.167677385775052 | -9.507708432507524 | -9.158941829779403 | -8.781333315856019 | -8.894984905303994 | -8.771287812826209 | -8.341951567395332 | -8.987098542804627 | -8.600336641965017 | -8.734765590491472 | -8.720455216707384 | -8.85259349513054 | -8.74800309617797 | -8.760036707027417 | -8.658365459351174 | -8.449508770820355 | -8.249339796868737 | -8.884459024265494 | -8.236025029490024 | -8.324609170526088 | -8.100084698412575 | -8.676952480500619 | -8.360173854466485 | -8.93404166953319 | -8.262683499248972 | -7.9153214035675346 | -8.646370220444961 | -8.31343773752329 | -8.580229558324561 | -8.553300400718834 | -8.212330434592985 | -8.847604994283667 | -8.918740282712648 | -9.00121452126763 | -8.649251251925076 | -8.159276392817564 | -8.423563039550505 | -9.10453389216563 | -9.295055611135716 | -8.41728178874854 | -9.141808221452152 |
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| # Mean fold change values, corrected using median metabolite fold change values per batch | ||||||||||||||||||||||||||||||||||||||||||||||||
| Mean FC values (based on 2^log-average, or arithmetic mean of log values) | M129_timecourse_6h_3 | M129_timecourse_24h_3 | M129_timecourse_48h_3 | M129_timecourse_96h_3 | 24h_timecourse_4 | 48h_timecourse_4 | 6h_timecourse_4 | TF173_MPN303_5 | TF178_MPN250_5 | TF187_MPN674_5 | Tn051_MPN051_5 | Tn674_N/A_5 | WT_WT_5 | dldh,NoxE_N/A_5 | AA_perturbation_6 | Fe_perturbation_6 | Glu_perturbation_6 | Gly_perturbation_6 | KO51_mutant_6 | Ox_perturbation_6 | TF173_mutant_6 | TF183_mutant_6 | TF414_mutant_6 | TF462_mutant_6 | TF463_mutant_6 | Tn674_mutant_6 | blank_control_7 | Gly_ctrl_perturbation_7 | TF173_mutant_7 | TF178_mutant_7 | TF184_mutant_7 | TF187_mutant_7 | TF413_mutant_7 | TF462_mutant_7 | TF463_mutant_7 | Tn051_Gly_perturbation_7 | Tn674_mutant_7 | WT_perturbation_7 | WT_noGluc_perturbation_7 | water_control_7 | ||||||||
| Batch | 3 | 3 | 3 | 3 | 4 | 4 | 4 | 5 | 5 | 5 | 5 | 5 | 5 | 5 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | ||||||||
| m/z | metabolite | KEGG ID | ||||||||||||||||||||||||||||||||||||||||||||||
| 59.015 | Acetate [-H(+)] | cpd:C00033 | 0.41391304742582036 | 0.5688158946859657 | 0.37885482151304395 | 0.32973165794624637 | 0.9561460140375926 | 0.7518169456012357 | 1.1450515023070658 | 1.1457843328906872 | 0.7845822707880752 | 1.0750704080567381 | 1.0510079074411252 | 0.9318137735433951 | 1.2380674908668747 | 0.9359332458747276 | 0.9113795810145321 | 0.852551503357438 | 0.6798857787829208 | 1.0449705553605604 | 0.7937564770008588 | 1.1016810572099287 | 1.0729652389738658 | 1.0973358666007702 | 0.9697431103555777 | 0.9607452995824489 | 0.9195223241493222 | 0.833589863843349 | 1.154952918276792 | 0.981959434640156 | 0.9673732150584232 | 1.0268935132679728 | 1.1155317582130444 | 1.2716099467556208 | 0.9709196779470484 | 1.0074737667335838 | 1.0933095402184903 | 0.8553547463253761 | 1.0945056565246152 | 1.1431397707801667 | 0.4671331686436608 | 0.8899824227431168 | ||||||
| 74.026 | Glycine [-H(+)] | cpd:C00037 | 1.5206772494372642 | 1.3448094948840827 | 1.5526233284134083 | 1.1335420224850683 | 0.965484730917634 | 0.9541750169578833 | 1.0577342447153437 | 0.9302510932264458 | 1.0384199095006081 | 0.9826494254477719 | 1.045193717636583 | 0.916098500248387 | 1.0056240277690596 | 0.9252703593737858 | 3.462410469513057 | 1.1481929886985658 | 0.8834117809228381 | 0.9466296004428911 | 1.018166205957791 | 1.0471744718362497 | 1.0712509335120928 | 1.0419109761584542 | 0.9145393647946664 | 0.9163176060752098 | 0.9266800756912654 | 0.9903503348378949 | 0.8928815770036378 | 1.0389452326830024 | 0.9053862366274343 | 1.0731282002755842 | 1.093671594763739 | 1.1052472330107743 | 0.9945789010885143 | 1.094430438546337 | 0.9881335616844324 | 0.9342316639678016 | 1.1532989849311064 | 0.9820288656138665 | 0.7775261757291676 | 0.7537743486764925 | ||||||
| 87.007 | Pyruvate [-H(+)] | cpd:C00022 | 0.8797015915680265 | 2.7374863962936766 | 2.338193815367179 | 3.3360709322117006 | 1.3970435171617932 | 0.7337676070499917 | 1.2865308894761802 | 0.9155042618947604 | 1.191668693096022 | 1.1140245516271972 | 0.9323936485266614 | 1.0353018537053342 | 1.1164299162775757 | 1.0378719754374617 | 0.8053354764714313 | 1.43944968304706 | 0.668011840300417 | 0.8661809979368797 | 0.5698579578583572 | 0.6258323614751383 | 1.2622486195052551 | 1.1904149488374918 | 1.180978798678424 | 1.3715708810851885 | 1.2484426980360308 | 0.9747916486147639 | 0.9943580854516526 | 1.095758035135992 | 0.827698885767989 | 0.9816344940774957 | 1.130305011140209 | 1.1773201911344218 | 0.8464623836926792 | 0.9931651366095623 | 1.1473164467083397 | 0.8626007535638385 | 0.9920416126671212 | 1.1173118290393027 | 0.794195072388656 | 1.7019953463280864 | ||||||
| 88.041 | L-Alanine [-H(+)] | cpd:C00041 | 1.2368512606020607 | 1.2220611673975141 | 1.105003253417283 | 1.2289303841965544 | 1.0438262312659419 | 0.9873187530868657 | 1.009232546540726 | 1.0424226092755988 | 0.8558688098832956 | 1.0571132450543936 | 0.9823141361780251 | 0.8600910409911406 | 1.1852980328928011 | 0.9411253176634882 | 0.9666648757927401 | 1.009586876335 | 0.9412555788572994 | 1.1316230811277455 | 0.9739830534997083 | 0.9831026455040576 | 0.9885782740673127 | 0.9908615589252504 | 0.9713473348801289 | 1.0144639083640565 | 1.0190623427685417 | 0.9518712195618395 | 0.9864104847505082 | 1.0137443842384628 | 0.984197816577571 | 1.0099564603061428 | 1.002798972876265 | 1.0222851905285937 | 1.032102280165311 | 1.011821357451743 | 1.0504249977573772 | 0.976598585042909 | 1.0054622520969887 | 1.0181787471139843 | 0.948327496741061 | 0.9843073140249963 | ||||||
| 89.026 | Glycerone [-H(+)] | cpd:C00184;(S)-Lactate [-H(+)];D-Glyceraldehyde [-H(+)];cpd:C00577;cpd:C00186 | 4.417133743499332 | 2.9298699297752293 | 2.5672020478787 | 4.602604875184193 | 0.9946861655399597 | 1.1628465844455855 | 0.914571306824668 | 1.0932893318488786 | 0.8981233182661972 | 1.0743622858008075 | 0.9740443126993568 | 0.9207506358111854 | 1.2291484036733396 | 0.9568804995538286 | 1.0425289639423354 | 1.1466695964418765 | 0.7373586104367713 | 1.1068825843826038 | 0.8557517091046446 | 0.888212650660439 | 0.8822566512769306 | 0.883720302410986 | 0.9021603917521043 | 1.1223432438159062 | 1.0156344300125493 | 0.8553952306953854 | 0.9830804596225372 | 1.2179904119115694 | 0.8505198286482081 | 0.9955268960659669 | 1.2183798643730444 | 1.1170525391316413 | 1.0266944896431083 | 1.048577584066447 | 1.1267483803713372 | 0.7690066999088697 | 1.12232187815572 | 1.1275952337094806 | 0.7453794361827465 | 0.8488585524528128 | ||||||
| 91.04 | Glycerol [-H(+)] | cpd:C00116 | 0.5798151314075234 | 0.6752602012859396 | 0.6866504223450816 | 0.8306092562658068 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.5639994031690554 | 1.0049358756768763 | 0.8400268458577694 | 19.51764066618491 | 0.6203475977034821 | 0.8201471819121742 | 0.9477340294151969 | 1.001576232938 | 1.0572564303808436 | 1.034249620863652 | 1.272288409150704 | 1.1368986869686597 | 1.1131630690294188 | 9.979665526717959 | 0.8093059476688843 | 0.9829570747403262 | 1.0408124212453604 | 1.066472884569876 | 0.8414972719540641 | 1.01430022837862 | 0.9629230730596118 | 2.2565417981946796 | 1.353392297621366 | 1.1363116432385623 | 0.7786515050338156 | 1.5250084472015668 | ||||||
| 94.03 | Glycine [+F(-)] | cpd:C00037 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.9912191854602971 | 0.7205464024722456 | 1.097192073048719 | 1.0840463358773709 | 0.8949473441421443 | 1.3278955456321142 | 1.1056169309502706 | 1.0458125864031043 | 0.9621770398299262 | 0.9110885746061976 | 1.200581862762013 | 0.9099630054289263 | 1.3214917123405687 | 1.0168159252784859 | 1.1750587737195572 | 1.0003211803239895 | 0.9335213481295008 | 0.9890147023374564 | 0.9862650397966182 | 1.152330243047607 | 0.6041696272975875 | 0.7051235404769879 | 1.2256319305330223 | 1.3478163709400877 | 1.580079112464916 | 0.7479442350574392 | 1.2666915621268948 | 0.8408903745784042 | 0.6342973154809682 | 0.8573748038487915 | 1.0486439464189692 | 0.42311064263103804 | 1.0186402343134642 | ||||||
| 96.97 | Orthophosphate [-H(+)] | cpd:C00009 | 0.42149980670454945 | 0.5011606203572979 | 0.5489062999839617 | 0.6723582455940159 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0894713186658456 | 1.0470558676709212 | 0.8366368367928533 | 0.8806683246494331 | 0.6873690416788762 | 0.9159426407470742 | 1.1246447429985607 | 1.122611059622912 | 0.9759027492170833 | 0.9997139000406485 | 1.0222666217074121 | 1.0534487676108282 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 104.036 | L-Serine [-H(+)] | cpd:C00065 | 1.857801319510743 | 1.559573023870503 | 1.30457890942706 | 1.1488171487386278 | 0.9698019279009059 | 0.911334113617606 | 1.1361070605382189 | 1.0929418901853865 | 1.0075976570660934 | 0.9789740137308259 | 0.9656525058646672 | 0.8956165047290918 | 1.0495131871908667 | 0.9478413003053296 | 2.0752656314828046 | 1.1587393830679114 | 1.0289619366169207 | 0.9861742822757824 | 1.0143828793916905 | 0.8178933544735546 | 0.9678184599506023 | 0.9503344894478941 | 1.0442108620529431 | 1.0619281776536813 | 1.0364423256455928 | 1.0783266532639866 | 0.874111711482386 | 0.9637186533711166 | 1.0070583785166103 | 1.040670281924698 | 1.0988009371383893 | 1.0392058359230407 | 1.1046045048872857 | 0.998646625214207 | 1.127695681387717 | 0.9693277333495709 | 0.9114832329942786 | 1.0174662682327995 | 0.7804746824100788 | 0.6633891244217024 | ||||||
| 107.013 | Pyruvate [+F(-)] | cpd:C00022 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.1547394941962235 | 0.9692586486410961 | 0.9393911117728905 | 0.9573898027381185 | 1.0885737547523144 | 1.09344838944688 | 0.987070250769684 | 0.9574116858874997 | 1.0127120701071333 | 0.8859164588313764 | 1.0032463653676922 | 1.0665015306825796 | 0.7422309699098333 | 1.203334868782894 | ||||||
| 108.046 | L-Alanine [+F(-)] | cpd:C00041 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.1135859667846182 | 1.0132027025892065 | 0.9962126284009225 | 1.0912196977961381 | 0.7744800649013515 | 1.136675645027636 | 1.0516765230606653 | 1.1065445961276856 | 1.0524123047079892 | 0.9397482647217115 | 1.098673655116237 | 1.022632653320455 | 1.099107518683113 | 0.9861166099598755 | 0.7726320458011524 | 1.0647941266193208 | 1.078650908511294 | 1.1691939741450827 | 0.742037118828084 | 1.0731701803041707 | 0.951930213135304 | 0.8502048197939351 | 0.7843731829237175 | 1.1016698742965194 | 0.7383869550052833 | 1.638392159834781 | ||||||
| 109.03 | Glycerone [+F(-)] | cpd:C00184 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0368075171065092 | 0.9878424321387262 | 0.9660596781960581 | 0.8617116737587952 | 0.7602414373849116 | 0.8736724088998133 | 1.2706732061418669 | 1.117190820643546 | 0.9991389400731874 | 0.9482854599194283 | 0.9837263174726587 | 1.001524792815123 | 1.0144670294072498 | 1.1625193485952159 | 0.8121631307264842 | 0.9898661801129512 | 1.0561767992874278 | 1.1453011279379364 | 0.8117698429090315 | 1.0117348905759818 | 1.006745959362943 | 0.8444032666351432 | 0.964388951017387 | 1.125649544944429 | 0.7591966864903461 | 1.6407747324968738 | ||||||
| 111.02 | Uracil [-H(+)] | cpd:C00106 | 0.9804113062199368 | 1.261521361563231 | 1.0435300714193458 | 1.110631797002001 | 1.0539281015608473 | 1.0665278911113483 | 0.9191101376525035 | 0.9278915644687159 | 0.9229543305585396 | 1.1722917810675246 | 1.098710222404499 | 1.02338928940067 | 0.971301913884809 | 1.1408085380314967 | 1.067929459592195 | 1.1496621472721038 | 0.854454919978604 | 0.8895935419907053 | 0.8590132892841649 | 0.8729514840877186 | 1.0192238417848878 | 0.9470960770374867 | 0.92444283648131 | 1.0407229299105671 | 0.9933831419904868 | 0.9993142674012663 | 0.9944499558321942 | 1.0638031331512752 | 0.8776970879533158 | 0.9969632930462775 | 1.0278643973921244 | 0.974959147248591 | 0.9907164339876025 | 0.942341023282373 | 1.0736053780597206 | 0.9650965608117947 | 1.0141185250134204 | 1.0947370133373147 | 1.0135627334191428 | 1.3663854207455606 | ||||||
| 111.045 | Glycerol [+F(-)] | cpd:C00116 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.065496815466297 | 1.202770030984217 | 0.7900554889505379 | 1.0062453975021017 | 1.0260143783195563 | 1.1149606963541123 | 0.8052138267874409 | 1.0045684361325256 | 1.0281590003655547 | 0.8793175564426604 | 0.9132876530964531 | 1.1009318571087499 | 0.7560630867388879 | 1.7184148656264537 | ||||||
| 114.056 | L-Proline [-H(+)] | cpd:C00148 | 1.6806288858901461 | 1.1146618873148513 | 1.2773970297346264 | 1.1460898881720978 | 1.0139273628742915 | 1.1330505709002772 | 0.8837895809992957 | 1.1056743824905855 | 0.8463112260060334 | 0.9338288382587858 | 1.0220744287814214 | 0.7865061613891406 | 1.030920449623625 | 0.9326069817988787 | 0.9658291193257292 | 0.6514483247651034 | 1.672312565234211 | 1.0104140623262716 | 1.1437595350627487 | 0.8023467700876665 | 1.126101154703407 | 1.3384652918479474 | 1.182666798657844 | 0.9487616826672544 | 1.0841145287816643 | 0.8420082475547329 | 0.6566105101558711 | 0.8921002013044114 | 1.0043395987733983 | 1.0426269965603856 | 1.0087652837690222 | 1.0686817539317575 | 1.1298834675799472 | 0.9525030954373779 | 0.9903417025638832 | 0.9370996485258952 | 0.9018769221069843 | 0.9907173903231173 | 0.9211285176399862 | 1.1667934201888832 | ||||||
| 116.072 | L-Valine [-H(+)] | cpd:C00183 | 1.0687572276701416 | 1.077815076415481 | 1.1109171144509125 | 1.1023503831720474 | 0.9893385857559677 | 1.0408985608338317 | 0.9390061513037719 | 1.0363144153234631 | 0.9644718155439828 | 0.9913616435326887 | 1.0227773361548216 | 0.9971927401000111 | 0.9709102277740453 | 1.0314706385774939 | 0.97786465100529 | 0.99103578139255 | 1.0019551694961173 | 1.1109326814375513 | 1.0301251978104495 | 1.056558569611158 | 0.994617168191768 | 1.0119174301096876 | 0.9616253377900412 | 1.0222101388503737 | 0.970808268607114 | 0.9819928369564784 | 0.936205494716975 | 1.0153355107226487 | 0.9278384017074033 | 1.0036433626893548 | 1.006324144959087 | 0.9701958353765013 | 0.9820452866910296 | 1.0147795090021245 | 1.0018428175464802 | 0.9723296688581549 | 1.0400574788936734 | 1.0218896524995698 | 1.0192556082673432 | 1.0416512894209213 | ||||||
| 116.973 | Orthophosphate [+F(-)] | cpd:C00009 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0588754116486818 | 0.9793356674791058 | 0.9774603163532479 | 0.9707128609106083 | 1.178395189346997 | 0.9994795294440935 | 1.0465619842388048 | 1.0102262100264807 | 1.0304655897246295 | 0.7462210804560159 | 1.0844239772511532 | 0.7284372640339591 | 1.0595455377188734 | 1.1303180147925485 | 0.960650513167239 | 1.0898274957531902 | 1.230432349419936 | 0.8646014833343768 | 1.1278013043942394 | 1.0047823395690427 | 0.8670189553397901 | 0.9170048774220466 | 0.9554784448385469 | 1.1371190536148559 | 1.1427154764709164 | 1.2370004844545417 | 1.2686952944816487 | 1.1790141589742733 | 0.9484467077458131 | 0.8803700407968168 | 1.174734788531109 | 1.0000368728565787 | 0.5858342689820738 | ||||||
| 118.051 | L-Threonine [-H(+)] | cpd:C00188 | 1.8241368236349775 | 1.3855871638979143 | 1.3915248714995487 | 1.086546603489453 | 0.9943699012022683 | 0.9998588037469006 | 1.1180514297400752 | 1.0415051399126087 | 1.0040760437753407 | 1.005610271226301 | 0.9811003501579605 | 0.9551459659848915 | 1.0387079929710679 | 0.9924942568693316 | 1.1282859999628576 | 1.0879026993237113 | 0.97736023809063 | 1.0185266736863134 | 1.045184277574727 | 0.9388813098639912 | 0.967796877554864 | 1.023074516674727 | 1.0918808848375081 | 1.0275234266334667 | 1.0374422989035128 | 1.0597454771423087 | 0.9326244091551017 | 0.9296292520138794 | 1.0071545809370839 | 1.0133429408453407 | 1.0642100489761672 | 1.0753150100148956 | 1.0502418828125746 | 1.0329271413552135 | 1.0581851250990804 | 0.9697402912812737 | 0.9407576222710657 | 1.0053013191314768 | 0.7872699793907647 | 0.7627661692470777 | ||||||
| 120.012 | L-Cysteine [-H(+)] | cpd:C00097 | 0.6801732488555677 | 0.825987818795577 | 0.9371232165107616 | 0.7727068773979846 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.6178379906750927 | 0.6934985029672223 | 0.7774833270492454 | 0.7041214253436872 | 0.544801635378649 | 0.7711612024872141 | 0.782750175211525 | 1.2361082402816066 | 0.8885034702746599 | 1.0196815577368445 | 0.9077694468589108 | 0.6945755569609906 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 122.025 | Nicotinate [-H(+)] | cpd:C00253 | 0.6786176229375497 | 0.8532196144136822 | 0.7788806679051207 | 0.8492757546143518 | 1.0297580438417828 | 1.016138770788094 | 0.8827277499361426 | 1.0460424986825363 | 0.9347274436950433 | 1.204816587274626 | 0.9974477820570596 | 0.9124500485481025 | 1.2011011935019633 | 1.1290587423162517 | 0.9319016519740164 | 0.9744096069031902 | 0.8873831146333903 | 0.986358000848043 | 0.773762819536379 | 0.9872748246219224 | 0.9780543503211793 | 1.1945635454425478 | 1.0596203107513373 | 1.0128974130179897 | 1.0921401758890328 | 1.024945613043648 | 0.9923603907883283 | 0.7330412142662399 | 0.7410699340316398 | 1.0911989765562307 | 1.2304535677126007 | 1.3825476612416663 | 0.8367993708502662 | 1.2261903530087273 | 0.9734706134267087 | 0.715778609668067 | 0.9152913678107888 | 1.032165159271266 | 0.5262830338061093 | 1.3022854414146472 | ||||||
| 124.04 | L-Serine [+F(-)] | cpd:C00065 | 1 | 1 | 1 | 1 | 1.058361509354503 | 1.0231571048456074 | 0.8780142215122333 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.1044872758828248 | 0.9448393855873206 | 0.860268329034874 | 1.295459123945216 | 0.9043955234005905 | 1.446457862015486 | 0.9306717313047662 | 1.0238332584323284 | 0.9411219246104148 | 1.0165225594567437 | 0.9883657661664892 | 0.8793199069231216 | 1.0802054596907344 | 0.7229053256674952 | 0.713241605032368 | 1.1148193148125485 | 1.2580395936542308 | 1.413013126566973 | 0.71858890751437 | 1.2297112501764067 | 0.8533902274995184 | 0.685175856530602 | 0.7849797244050949 | 1.019868678959831 | 0.5323345641820858 | 1.2152105356491536 | ||||||
| 125.036 | Thymine [-H(+)] | cpd:C00178 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.4710959028419441 | 1.067172690696047 | 0.8201172621115509 | 0.9091493884390769 | 0.7869139560911629 | 0.9213830508115914 | 1.0828084156898716 | 1.1287020735030118 | 1.020405501146375 | 1.0650699110096697 | 1.0630295457679493 | 0.9647286346250382 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 130.087 | L-Leucine [-H(+)] | cpd:C00123 | 0.9734584193364941 | 0.9768281825447362 | 1.0019887344570477 | 1.0453675799800155 | 0.9965654250009032 | 1.066957105330482 | 0.9890989892301996 | 0.978790191812287 | 0.9991442253104751 | 1.0163511629030466 | 1.0226991903415572 | 1.035007039383335 | 0.966744835654976 | 1.056925300776802 | 0.9863349387149135 | 1.000646863224435 | 0.9573665282175428 | 1.050364119619851 | 1.0377394258011208 | 1.0674278038488991 | 0.9807571523085354 | 0.9885041682480318 | 0.9940161774179418 | 0.9832407533763879 | 0.9857115602712807 | 1.0124290437889587 | 0.9988877836312041 | 1.0235744797322484 | 0.9755706340548372 | 0.9843155946020008 | 0.9897565980469267 | 0.9775856870406059 | 0.9697189369431988 | 1.0247398137003925 | 0.9900080827915936 | 0.9983607622309221 | 1.032701515834108 | 1.017776311110325 | 1.0408731833112856 | 1.0654675134511802 | ||||||
| 131.045 | L-Asparagine [-H(+)] | cpd:C00152 | 1.17512048549248 | 1.4449825516263652 | 1.1059044626140828 | 0.9416283344095068 | 1.0053172087641749 | 0.8477809923898992 | 1.086153063453008 | 0.903832278734902 | 0.9534848056577612 | 1.0013651895052034 | 1.0455260934817707 | 1.0148673765615626 | 1.0395454688889103 | 1.0627303899096407 | 4.29814540532944 | 1.4056773946652648 | 0.9007927695755958 | 0.9299064815775002 | 0.8484477524781443 | 0.9763153804528436 | 1.1095076477214476 | 0.9923911975762207 | 1.0744346413619528 | 1.1439069495094074 | 1.0854184819683337 | 1.1430917993628342 | 1.0828127107189138 | 1.071184343722093 | 0.9923685621181046 | 1.0022787013859498 | 1.0220566293696085 | 1.0246434019217785 | 1.0056938305186247 | 0.9775927434669907 | 1.1549483091895072 | 0.9997980726187464 | 0.9276685987653858 | 1.0700783976963721 | 0.8628730360512707 | 0.9642368600046554 | ||||||
| 131.082 | L-Ornithine [-H(+)] | cpd:C00077 | 2.4451456777703306 | 2.8254735011392533 | 2.9314130553223667 | 1.996880873125389 | 1.0550962917411095 | 1.0225580901713884 | 1.0278984907455055 | 0.978382865782262 | 1.1733310490440296 | 1.0855323241628216 | 0.9473051637003265 | 1.0896587097730235 | 0.9082395862128301 | 1.000201289288237 | 1.0562865789269014 | 1.003730437848815 | 0.9283916583584325 | 0.8342897715160469 | 0.8234884024592144 | 0.9235025651870786 | 1.1191172079227194 | 1.0658971574588514 | 0.9828385682883647 | 1.0446295526230103 | 1.0107942156109961 | 0.989172586814099 | 1.3573636874963997 | 1.1398248173878385 | 1.0744374562748045 | 1.1821621341705282 | 0.9425728062154 | 1.0038673736181212 | 1.0567530845787405 | 0.8536782246938619 | 1.0460783669184168 | 1.0896932098430347 | 0.8956743582597236 | 1.0178710309378673 | 0.8528858564753719 | 0.5447235905322068 | ||||||
| 132.03 | L-Aspartate [-H(+)] | cpd:C00049 | 1.8889364165836902 | 1.1639289589982147 | 1.5052633124675543 | 1.2971074234992914 | 1.0770732321917686 | 1.1930032462398592 | 0.8248235993962763 | 1.1278926895374406 | 0.8725533204898135 | 0.9089966470899724 | 0.9473910573040975 | 0.7654185748112469 | 1.2099276859001404 | 0.896177542075205 | 1.0258772640437415 | 0.9280758277941971 | 1.0610278651273692 | 0.9227511094767107 | 0.8973318522536793 | 0.869652155272092 | 1.1460016886459 | 1.1412371960767338 | 1.1112326431767585 | 1.044830127416982 | 1.1753121240557158 | 0.9661185824202239 | 0.7166892210861998 | 0.9681978095685044 | 1.0140279499204785 | 1.0501987167763376 | 0.993734595947632 | 1.10931348116237 | 1.1672424128180983 | 0.9671149013623768 | 1.0598513148847508 | 0.9052273906985041 | 0.8731487211214116 | 0.9650944507485529 | 0.9011393653773361 | 0.670469593039643 | ||||||
| 134.029 | L-Homocysteine [-H(+)] | cpd:C00155 | 1.1034812800100886 | 0.9314143882697412 | 0.8645928000531585 | 1.1071816174940499 | 1 | 1 | 1 | 0.931698803473651 | 0.8098001927494335 | 1.113049967762247 | 1.007746491700204 | 0.9309180707062151 | 1.1508243646468208 | 1.157163102150252 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 134.047 | Adenine [-H(+)] | cpd:C00147 | 1.2598398720329274 | 1.2383749471020744 | 1.3778350944629418 | 1.3718417509425376 | 0.993476249626437 | 1.1218411140827245 | 0.9267419793141181 | 1.0159196952502867 | 0.937955615430195 | 1.0000459931881314 | 0.8426549648024567 | 0.9452482089146607 | 1.0600264189377824 | 1.0242338795294763 | 2.0761174220337533 | 2.1412301963529314 | 2.34086890261305 | 1.7226756461233268 | 0.5489428250286438 | 1.7335566950808885 | 2.241470650773031 | 2.305843680615942 | 2.150345605160993 | 2.206089942078066 | 2.213692860154681 | 2.280305437590958 | 0.8100955094823922 | 0.9568005213018075 | 1.0446010646651096 | 1.00463656447892 | 0.9630134607328378 | 0.9179880123094326 | 1.1343492813009997 | 0.9489935768452255 | 1.0471966141208084 | 0.9526335484655318 | 0.901981008343963 | 1.0334247160855627 | 1.0980351724936457 | 1.0450507280692714 | ||||||
| 134.061 | L-Proline [+F(-)] | cpd:C00148 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.1821326315285001 | 1.152268910053751 | 1.0482231900408165 | 0.9643305005095086 | 0.6416091083869672 | 1.3283476480770335 | 1.2149471513237258 | 1.1755395794616688 | 1.139721551041754 | 1.1824534465126098 | 1.1636081972869114 | 1.1612308988015498 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 136.077 | L-Valine [+F(-)] | cpd:C00183 | 1 | 1 | 1 | 1 | 1.0640815812244446 | 1.1640480743350343 | 0.8507751661354597 | 0.7489586992237919 | 0.8563120600807905 | 0.9325947232951884 | 1.1323599658852095 | 0.9242733148504076 | 0.9330233347586088 | 1.1509622903665855 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0617988536086487 | 1.0636909084022719 | 0.8502825326984962 | 1.0162545996159014 | 1.0084407441677579 | 1.0021657527176766 | 0.8038052866475083 | 0.9685015691347676 | 0.9593821546758102 | 0.8968453318123466 | 0.8409547949037248 | 1.1039730257188414 | 0.8734037433079619 | 1.4203079942648513 | ||||||
| 138.056 | L-Threonine [+F(-)] | cpd:C00188 | 1 | 1 | 1 | 1 | 1.0356150266532749 | 1.0781051220968867 | 0.7419216813027361 | 0.8594066376220401 | 0.8399111557534756 | 0.9775549558929082 | 1.1642598301963285 | 0.9837471123429343 | 0.9888097769730206 | 1.1576708745586632 | 1.0179764730294414 | 1.074482128665557 | 0.8735797845848705 | 0.9651371606752731 | 0.7840450716734214 | 0.9858534447120902 | 1.0858685917668007 | 1.1456013167682304 | 1.0237062522302938 | 1.0341092088647348 | 1.0813246649527597 | 1.0289249977588713 | 1.07793038517362 | 1.0079906502368021 | 0.8430041774787065 | 1.0415050025123527 | 1.0431891986171495 | 1.0642922654278244 | 0.8471684488528196 | 0.9784610148605692 | 0.9982113690637745 | 0.8878769132451111 | 0.8653744021446954 | 1.1085916988702325 | 0.763103301300421 | 1.5912457079561917 | ||||||
| 138.98 | Acetyl phosphate [-H(+)] | cpd:C00227 | 0.8013140202239748 | 0.7931605862806308 | 0.9358276246763862 | 0.7435736698494895 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 139.975 | Carbamoyl phosphate [-H(+)] | cpd:C00169 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.9245120231816851 | 0.8143339661550933 | 1.0546660042084999 | 1.1059203219941833 | 0.9728659168346714 | 1.2171539167561007 | 1.1518551203482257 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0767867554075397 | 0.9330272313013707 | 0.8670805744588357 | 1.0605536901291337 | 1.0393573184761848 | 1.052442390946533 | 1.0960868442722194 | 0.9237436803868233 | 1.0843509416853787 | 0.8250427236711673 | 0.934837763081247 | 1.0144887350678287 | 0.9438290843196805 | 2.306097273926699 | ||||||
| 145.041 | Thymine [+F(-)] | cpd:C00178 | 1 | 1 | 1 | 1 | 1.0055692346662954 | 1.1511734586045987 | 0.7046915793994158 | 0.8496636723526296 | 0.9291958137867183 | 0.9550650209933899 | 1.1347091956644104 | 0.9572848907477773 | 0.9719854429461287 | 1.1252573687353482 | 1.3024503601060475 | 1.1060270979770528 | 1.032291286092409 | 0.8586080314282291 | 0.6717205448808303 | 0.8199759423529228 | 1.0230876249172214 | 1.2646444079052706 | 1.1057661323630334 | 1.088163761896325 | 1.1398854260704208 | 1.0162656702779813 | 1.0635235344347156 | 1.1058391199945148 | 0.8695627774155156 | 0.9887040527526708 | 1.0031408433088775 | 1.076227270947853 | 0.7515430189532598 | 1.0154018515835679 | 0.989858254791348 | 0.9070451717426086 | 0.8309389174475663 | 1.1222837097778116 | 0.7800391204187872 | 1.5318111921285182 | ||||||
| 145.062 | L-Glutamine [-H(+)] | cpd:C00064 | 1.117191654880602 | 1.4777609369046394 | 1.46653732017076 | 1.2344329915137402 | 1.0264885759074542 | 0.9141551043470163 | 1.0452103901003522 | 0.8531905605046505 | 1.179084159478928 | 0.8604040556873457 | 0.9570792748374651 | 1.0843445700052117 | 0.8665237075031264 | 0.9988802664424037 | 2.179084913693663 | 1.2551865685180164 | 0.7610525640327502 | 0.8076089184063396 | 0.9314383513541737 | 0.8850831830841359 | 0.9914870156074659 | 0.8484713990603754 | 0.9536203237275651 | 1.0747467172787069 | 1.0466996535881337 | 1.0487683251763156 | 0.9026493049621382 | 1.2266483608958192 | 0.9726367038293223 | 0.9156107646826795 | 0.9841032373012938 | 0.8145856477428788 | 1.1166372340984132 | 1.0520802246907068 | 1.2745338520130562 | 1.168465351377596 | 1.0670990939610696 | 1.0137696440139246 | 1.087347668210805 | 0.5665453098453123 | ||||||
| 145.098 | L-Lysine [-H(+)] | cpd:C00047 | 3.670705048097771 | 3.815289983833292 | 3.766414033711174 | 2.5977295637308915 | 1.011905829138922 | 0.9662189248131032 | 0.9257253263307321 | 0.9986371516054171 | 1.3705652129222592 | 1.0827962955998005 | 0.8782953475248692 | 1.1121602154899972 | 0.9107783862116142 | 0.9463719962757372 | 1.0493043453832656 | 1.0537295412791596 | 0.9755462751318114 | 0.9011974544886717 | 0.9921027843658016 | 0.97651895396887 | 0.9870492643195949 | 0.9525420807822953 | 1.0015937481031547 | 1.0378100336541707 | 0.9992538214240436 | 0.9899827868067808 | 1.3615401547903918 | 1.1513121481624797 | 1.1027427388537274 | 1.1828904428270637 | 0.908623235702665 | 0.9810425651341624 | 1.1123903208259969 | 0.8225881911211461 | 1.0448377035300378 | 1.1101425722589537 | 0.9278836466257381 | 0.9752116005823711 | 0.8852838190949144 | 0.4217088622044454 | ||||||
| 146.046 | L-Glutamate [-H(+)] | cpd:C00025 | 1.4295520394402788 | 0.9797921340074581 | 1.1636280942684023 | 1.1353008072106505 | 0.9859631051742535 | 1.186478166546601 | 0.8353990038346158 | 1.0724531212475727 | 0.9049737121619305 | 0.9242512110583841 | 0.9364788363478942 | 0.7806173835466453 | 1.1259070831121798 | 0.8502151719676052 | 1.0444667675263204 | 0.9766455108289002 | 1.0114817246428036 | 0.890419911587263 | 0.9662169656131003 | 0.891225037429358 | 1.100591409034746 | 1.1095303918382347 | 1.101373542248368 | 1.0028330604193938 | 1.1492596256561671 | 0.968608453686186 | 0.8430594220726341 | 0.8833840952890355 | 1.0914672503129093 | 1.0320080526119901 | 0.992063403894916 | 1.1189916840520424 | 1.1499901838029616 | 0.941110010766342 | 1.0600473222372664 | 0.9310372803505245 | 0.7908394125747868 | 0.9651923383213789 | 0.93619646068706 | 0.6642914492592978 | ||||||
| 148.043 | L-Methionine [-H(+)] | cpd:C00073 | 0.9205440229898678 | 0.9590057552258305 | 0.9943952047775089 | 1.0009699252330537 | 1.0161874180762702 | 0.9111967095539029 | 1.0366147616085613 | 0.9643047853191281 | 0.9759671753680715 | 1.0146916467430338 | 1.0877227895614507 | 0.9749375126337941 | 1.1442059585102013 | 0.9941528153785585 | 0.9998334405620481 | 1.0316352303528344 | 0.9437049906951758 | 0.8529665855496366 | 1.0763072310716986 | 0.20844414390976423 | 0.9729777224493522 | 0.9469440417906276 | 0.9892044813184979 | 1.0180950240279492 | 0.9950650266369884 | 0.9851790568523544 | 1.0468479977263825 | 0.9139827662423488 | 0.9209712924345896 | 1.0593628525914645 | 1.107251307588401 | 1.1601161511006526 | 0.9423670146584002 | 1.07530949028993 | 0.9826821004934105 | 0.8990442369761663 | 1.04054991469391 | 1.0381915412137686 | 0.7824073144029117 | 0.9814544415176184 | ||||||
| 149.046 | D-Ribose [-H(+)] | cpd:C00121 | 0.9261565635497045 | 0.9577016094090565 | 0.8803072329645366 | 0.6574597804853082 | 0.9813238719681484 | 0.8258868621386648 | 1.1774063610678553 | 1.0912349379759994 | 0.7478773053018073 | 1.1856538878055776 | 0.9222835208865253 | 0.8044776640230862 | 1.4223036747607103 | 0.9974050631388462 | 0.9495481221219205 | 1.2816053677824761 | 0.6264240435763312 | 1.0190494435922728 | 0.712438539766462 | 0.8617273905397365 | 1.2913865229292107 | 1.1301262450426461 | 1.2475405724581434 | 1.2330192769355048 | 1.2789359280114534 | 1.2765590721720725 | 1.2174287230697105 | 0.629435732830306 | 0.7169557731375252 | 1.2781129332441228 | 1.5214471322022072 | 1.927942144196935 | 0.8532070770644584 | 1.404784577516525 | 0.8599644773340632 | 0.5540748478933673 | 1.1935153330506385 | 1.1457409791271933 | 0.31983934728085844 | 0.9523074755201294 | ||||||
| 150.042 | Guanine [-H(+)] | cpd:C00242 | 1.035162880323478 | 0.9293642949292402 | 0.8433441590615222 | 0.6375344441656707 | 0.9571768402711741 | 0.8621972290523798 | 1.1947109464168315 | 0.9741292002682748 | 0.9257718345575 | 1.0518532141373171 | 0.9781217812359622 | 0.9142714648486442 | 1.0974778462447399 | 0.9811890132696761 | 0.9208992196797471 | 1.0431265782380248 | 0.7963354078581042 | 0.8780601874626566 | 0.8958717645777836 | 0.747420153532364 | 1.021411135713338 | 0.9320264727820728 | 1.0204282973457566 | 1.026321934553421 | 1.0901235072704658 | 1.010638856049701 | 1.0499216828036975 | 0.9120859352963021 | 0.9437978987757588 | 1.0815765585840356 | 1.0086877201290667 | 1.0069360185109266 | 1.0365317477166633 | 0.9418378946633833 | 1.0093681412679771 | 0.9290510120550375 | 1.0193095369035132 | 1.0206225103032929 | 0.8951110888512746 | 1.045676085473032 | ||||||
| 151.051 | L-Asparagine [+F(-)] | cpd:C00152 | 1 | 1 | 1 | 1 | 1.0642502113503556 | 1.0795030349243881 | 0.7665415373486223 | 0.8319312016045417 | 0.8781011821449216 | 1.0135824099242583 | 1.1992857031240187 | 1.0002949032739075 | 0.9498102647561123 | 1.0975178908705419 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.094673326308765 | 1.074488981874919 | 0.9012040001882409 | 1.040458148704646 | 0.96666007083688 | 0.9960924421528047 | 0.8560336296771219 | 0.9415238083392441 | 0.9664863374946833 | 0.9600106104935873 | 0.9420049699019042 | 1.1223584516580607 | 0.8305232318615806 | 1.2421043679716146 | ||||||
| 151.087 | L-Ornithine [+F(-)] | cpd:C00077 | 1 | 1 | 1 | 1 | 1.1599565906846867 | 1.0469886046801413 | 0.8427392008674564 | 0.8561734727340965 | 0.9956000923472021 | 0.9015155649202563 | 1.0511108250065508 | 1.0708255215614169 | 0.8681794449667023 | 1.0026235779462924 | 1.0720508398341642 | 1.1188109521876335 | 0.7260231037240129 | 0.7027367496298413 | 0.5921311289661035 | 0.7003154101235759 | 1.1534846892584338 | 1.0414403222677184 | 1.1615182848396737 | 1.132422032088773 | 1.2467711248152036 | 1.1692528763395877 | 1.3694910749219609 | 1.2369757254714875 | 1.0578286789923317 | 1.0993336869110206 | 0.9403146285167033 | 0.8703428679117027 | 0.9026700719940846 | 0.7359272703541694 | 0.9723230341299639 | 1.0198503558151684 | 0.9926498667727809 | 1.1214368505760666 | 0.7315164029878759 | 0.7251192486684223 | ||||||
| 152.036 | L-Aspartate [+F(-)] | cpd:C00049 | 1 | 1 | 1 | 1 | 0.9810006145956566 | 0.9391456043642075 | 0.982916025297238 | 0.898905093271915 | 0.887424483578681 | 1.0669731478502265 | 1.0532118952582608 | 0.9505459435358082 | 1.1022712983519625 | 1.146541866672833 | 1.010427361643311 | 1.0832004965137656 | 0.8073619384168246 | 0.9460148928970697 | 0.7044694351225372 | 1.6775154615608159 | 1.0787967467401811 | 1.015595448755111 | 1.0232359251923704 | 1.1258609624044122 | 1.0504284295001503 | 1.034578341756176 | 1.07713067654832 | 0.7720069963072819 | 0.7660624020965006 | 1.0978025598574372 | 1.2654122070476972 | 1.4410479451752276 | 0.8453043376436562 | 1.1614266635272454 | 0.9285941393038332 | 0.7151360341204117 | 1.0020166999038869 | 1.0713094497177962 | 0.5709857661055717 | 1.2646286171776533 | ||||||
| 154.033 | L-Homocysteine [+F(-)] | cpd:C00155 | 1 | 1 | 1 | 1 | 1.0986536597399035 | 1.1616708978161094 | 0.892398010843532 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.9068732531416337 | 1.1169531588245138 | 0.8494725300483634 | 0.946700855267353 | 1.0201143223355058 | 1.0827050617591103 | 1.0145338941781132 | 1.0524342367902035 | 1.1044185740748405 | 0.8877275532820501 | 1.0791755452084202 | 0.967880677868992 | 0.7540477901879715 | 1.076227200681117 | ||||||
| 154.052 | Adenine [+F(-)] | cpd:C00147 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.9148920258734315 | 0.9916640827066245 | 1.008707638191805 | 0.9920174929255723 | 0.9654657618302367 | 1.0929008440979622 | 1.0682780174629989 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0723133826949416 | 0.6340180380031694 | 0.6702310589189963 | 1.132945407758904 | 1.2534894158927528 | 1.466428788942871 | 0.7084446912982554 | 1.3509250714733003 | 0.7881388561005971 | 0.6057926831813666 | 0.8773910478171605 | 0.9770431206279134 | 0.5156667503629024 | 0.9899795768395323 | ||||||
| 154.058 | L-Histidine [-H(+)] | cpd:C00135 | 3.0325462449505642 | 2.320092845760129 | 2.317329550811826 | 1.6422276060091405 | 0.9794946258435261 | 0.947499556523847 | 1.1419808362133292 | 0.9849887617395314 | 1.1948005253802898 | 0.8862585883917641 | 0.8605426394363941 | 1.0151607877428501 | 0.9677149464088687 | 0.8774857715443481 | 1.030080415976307 | 1.0420913540229204 | 0.9060207409034566 | 0.8496766304827353 | 0.9511848507037948 | 0.9762229927042593 | 1.0066273385055844 | 0.9698107121066727 | 1.0116956369712153 | 1.011822554192928 | 0.9785298468192902 | 0.9840139361643068 | 0.9747047052807243 | 0.9477354160921159 | 0.9914672075141153 | 0.9859328420163566 | 1.0095947772109182 | 0.976227781604383 | 1.1236658665446386 | 0.943672203874681 | 1.1052276987956702 | 1.0115753373712293 | 0.9093601045501656 | 0.9877840877917694 | 1.0314530845052556 | 0.6411091070851265 | ||||||
| 159.977 | Carbamoyl phosphate [+F(-)] | cpd:C00169 | 1 | 1 | 1 | 1 | 1.0064989164641294 | 0.8287918227603953 | 1.3472095748594892 | 1.5984892199843292 | 1.2413906811263418 | 1.8497734167769044 | 0.8023054814011318 | 1.2863732296753816 | 1.8357534406796596 | 0.8253966001886147 | 1.1774426359205323 | 0.8501694345295376 | 0.974014860456385 | 0.8163116858245878 | 0.6242169322459743 | 1.642292784418959 | 1.1903380258489755 | 1.1337859234371623 | 1.0577284078905056 | 1.0178288333803283 | 0.9361266344379576 | 0.942764996736863 | 1.0184283919622905 | 1.0192458417761174 | 0.7155550688305904 | 0.9819611869689786 | 1.0564267239794074 | 1.0125853436529102 | 1.1259149728584508 | 1.0681808962287414 | 1.2149496042933705 | 0.807879404486517 | 1.0885713115567517 | 1.0116144730939627 | 0.9325479100334466 | 1.6271493265719568 | ||||||
| 164.072 | L-Phenylalanine [-H(+)] | cpd:C00079 | 0.8510280716838903 | 0.9859680684091149 | 0.8890083523010939 | 0.8581705675627519 | 1.0084534048140448 | 0.8987790427608982 | 1.0608219725134038 | 0.9853721193606623 | 1.0447614891637242 | 0.9776033767482716 | 0.9306725710814125 | 1.0271684845236844 | 0.9961571005506065 | 0.9487178471819195 | 1.002530246986933 | 1.0531784433889484 | 0.9712710020819786 | 0.9023748791836249 | 0.9264552465224548 | 0.9765889245064252 | 1.0144971639314602 | 0.9631156876930749 | 0.9981840553965617 | 1.0307129042663912 | 1.0084614228871598 | 1.0297396681383224 | 1.11177699500903 | 0.9950487934114238 | 1.0876252348782844 | 1.016747942991439 | 1.0176876537297488 | 1.0212430125056493 | 1.0470124535060272 | 0.9737496817945853 | 1.024234298637613 | 1.0529562541422517 | 0.9790062161107113 | 0.9705051616128673 | 1.0090795979730451 | 0.8691514411602721 | ||||||
| 165.067 | L-Glutamine [+F(-)] | cpd:C00064 | 1 | 1 | 1 | 1 | 1.0887272681490516 | 1.0375304723489427 | 0.862678025162392 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0231823805618159 | 1.076808465086237 | 0.8751674837614429 | 1.0212837369911132 | 1.0052925514369437 | 1.0048433496314524 | 0.8756469875629546 | 1.1124399986187188 | 0.9944257946859764 | 0.8612683107258877 | 1.2683349366125563 | 1.0993483060265252 | 0.7948137961880021 | 1.1583105169122867 | ||||||
| 165.104 | L-Lysine [+F(-)] | cpd:C00047 | 1 | 1 | 1 | 1 | 1.1431193949021916 | 1.0365907532162675 | 0.8559130790777907 | 0.8321408181981964 | 0.9783563506853554 | 0.9070303268163115 | 1.0263947609589013 | 1.0771070581703206 | 0.8841537068913101 | 0.9526364564720496 | 1.040405426777277 | 1.1346008262022589 | 0.7214952825395483 | 0.7779052995117209 | 0.5955250387582687 | 0.7386709450932243 | 1.089594536627102 | 0.9927980728325377 | 1.1153234055698662 | 1.0836475546774031 | 1.2419791947011007 | 1.0348034889726816 | 1.4609423102249142 | 1.2578526091678974 | 1.0413695407663601 | 1.1331637409820183 | 0.9388746418069515 | 0.9124897386325175 | 0.9814644930829205 | 0.6789481754517673 | 0.9690632359355799 | 1.0380193603921977 | 0.9810979227060487 | 1.1212400433911032 | 0.6802763701038709 | 0.6240425393448095 | ||||||
| 166.052 | Pyridoxal [-H(+)] | cpd:C00250 | 0.6289902910529792 | 0.7344959277743918 | 0.7053299646023267 | 0.6634994877476981 | 1.0085923530829435 | 0.9997092957725509 | 0.8541559327049798 | 0.9573462697206554 | 0.9166373386117602 | 1.1170121245850932 | 1.064424982026967 | 0.9985312443434746 | 1.1929924424538474 | 1.147188820922844 | 3.509713710309428 | 1.2561913571984582 | 0.8780470855206953 | 0.9595841191820526 | 0.8328235490995218 | 1.0105021681592163 | 1.084000482980184 | 1.1361414852214706 | 1.0271957899041373 | 1.0690321593180865 | 1.0206617602965027 | 1.038599698431493 | 1.0811342046491907 | 0.7764858392356813 | 0.7873188174773734 | 1.0990790928052903 | 1.1960718686889682 | 1.292627913592638 | 0.7979450087765764 | 1.10479079543946 | 0.9269243718346238 | 0.724241618110935 | 1.0138818076682221 | 1.060059235490654 | 0.5137421645117343 | 1.0884721113287 | ||||||
| 168.054 | L-Methionine [+F(-)] | cpd:C00073 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.8879503004999395 | 0.893312187408685 | 0.955155317845689 | 1.023314696502694 | 0.9692135237900094 | 0.9790942249806099 | 1.1106030901363813 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 168.991 | Glycerone phosphate [-H(+)] | cpd:C00111 | 0.9115126698943108 | 0.6054410559670669 | 0.8351267586067098 | 0.9482260852434536 | 0.9679744676032576 | 1.2056183202879653 | 0.8900946927761848 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 169.05 | D-Ribose [+F(-)] | cpd:C00121 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0457079480159412 | 1.2279344484577457 | 0.7850216869345742 | 0.9651047470224581 | 1.001227905407812 | 1.0387483333370204 | 0.8143748942481779 | 0.9587509577881392 | 1.0040162599426417 | 0.8816187833478165 | 0.8940552345111177 | 1.1310907673284645 | 0.7378192204161151 | 1.6673687437292755 | ||||||
| 170.045 | Guanine [+F(-)] | cpd:C00242 | 1 | 1 | 1 | 1 | 1.0180992338297354 | 0.957137059184112 | 1.027703038115175 | 1.0131918845665657 | 0.9505683096463252 | 1.0362873600124352 | 1.0378337993637254 | 0.9995103952268874 | 1.043526795743853 | 1.042784085210679 | 0.9562588779013095 | 0.982659748272927 | 0.8597767581397043 | 1.3425444838400462 | 1.1682330158986804 | 1.2814942023443603 | 0.8219453264753004 | 1.0119229005184744 | 1.0201852899338846 | 1.0694290690636363 | 0.932609316832297 | 1.0002245043142446 | 1.0561167660775186 | 0.8980246880502084 | 0.9643369687577488 | 1.0426366699404772 | 1.1005653020368613 | 1.0979789928041956 | 0.9200827045192261 | 1.0802923303450704 | 1.0403461179086295 | 0.9126042166663464 | 0.9416559596954158 | 1.0002279782470869 | 0.7418083991749017 | 1.18739056369683 | ||||||
| 171.007 | sn-Glycerol 3-phosphate [-H(+)] | cpd:C00093 | 1.1577008718791582 | 0.8112719807115163 | 0.5965780401477133 | 0.4314806231711629 | 1.3913648899458115 | 0.6779715571916775 | 1.041569260220708 | 0.886243912569609 | 1.013948833150919 | 1.0865234949377978 | 4.578122808207729 | 1.0197767692607709 | 1.1507437878346354 | 1.0226318560909584 | 0.9450745426330373 | 1.0804917180436453 | 0.6250413136563447 | 1.410036686684067 | 3.7297475585519604 | 0.799665125148123 | 1.161904232887532 | 0.9012410062962709 | 0.7968301276237901 | 0.9943617411229212 | 1.058957672830818 | 0.93664966957002 | 1.5457866288182804 | 1.7783102612841795 | 0.7873895067580292 | 0.7367352377743628 | 0.9583298259558082 | 1.1128852600100645 | 0.5794197151417757 | 1.0007576534659228 | 1.1275628972446838 | 4.097795944126474 | 0.9222694645715056 | 1.1570244922813575 | 0.9936973575780114 | 0.6485513707630837 | ||||||
| 173.105 | L-Arginine [-H(+)] | cpd:C00062 | 2.7988949611127345 | 3.070712739879352 | 3.0977450013683065 | 2.1417297164145195 | 1.0064530982252105 | 0.9410257577321165 | 0.959271930526789 | 0.9749673243279054 | 1.1758539318293348 | 1.0473644622138225 | 0.8869372028178841 | 1.083708496440479 | 0.8676206102309963 | 0.9813737188771344 | 1.085309750167091 | 1.0810406542773954 | 0.9625996749078161 | 0.8436724882468083 | 0.8466894779442865 | 0.9758037880154311 | 1.138456011949446 | 1.0983283154376702 | 0.9734411147998056 | 1.027019823835776 | 1.0210466757555803 | 0.9757156844882274 | 1.4291883835566295 | 1.1379315742527178 | 1.0734125512029846 | 1.1966019761687405 | 0.9171527261322777 | 1.0046663872503243 | 1.094198251876018 | 0.8173656601280576 | 1.0573975376231206 | 1.114992016671828 | 0.8865029897898503 | 1.004824200670758 | 0.8428141766070399 | 0.46421507636489173 | ||||||
| 174.067 | L-Histidine [+F(-)] | cpd:C00135 | 1 | 1 | 1 | 1 | 1.1073184520552595 | 1.096240811717918 | 0.8264158269765579 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0944564394606706 | 1.1260283681555503 | 0.9038792599489364 | 1.0354603909952742 | 1.0007074291037301 | 0.94224987094447 | 0.9064624173868782 | 0.9043707077029038 | 0.9729012703364578 | 0.9739157615558228 | 0.9490465086993556 | 1.17801955605837 | 0.9089371886489153 | 1.183641188717009 | ||||||
| 174.089 | L-Citrulline [-H(+)] | cpd:C00327 | 0.8294207108502495 | 1.0540822879117857 | 1.3018098095031552 | 1.2650185957978548 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0492376844532607 | 1.0081181488270505 | 0.9501475299359385 | 1.0205378192605223 | 0.9837574558570095 | 0.899506777746576 | 1.0036503184248835 | 0.9300791007487319 | 1.1306692429761 | 1.0029446697410747 | 0.9854029676879386 | 1.0075929894977353 | 0.8743970372132905 | 0.9423624091788272 | ||||||
| 175.026 | Ascorbate [-H(+)] | cpd:C00072 | 1 | 1 | 1 | 1 | 1.0687217003580503 | 0.9046212775451902 | 1.0066484471745667 | 0.937106465496562 | 0.9482158659577338 | 1.0639651064707363 | 1.228918747367265 | 1.044654554265348 | 0.9761912269660715 | 1.334402843396946 | 0.9665579130123197 | 1.2398659110805854 | 0.653248227224609 | 0.9420398818454904 | 0.600257528967457 | 2.7013293916182857 | 1.2827036959985807 | 1.17805566771832 | 0.9479807369083272 | 1.0789541357900403 | 1.1308806576653985 | 0.9051690615368089 | 0.792059023586016 | 1.3821220840748714 | 0.7007070007986461 | 0.9276708769840571 | 1.2794847605277946 | 1.2034256205975553 | 1.1732398653438159 | 1.1656222633761575 | 1.5035867487897179 | 0.777746305542773 | 1.7036677508656386 | 1.1910283786475 | 0.8247989229500137 | 1.5145986139315388 | ||||||
| 176.936 | Diphosphate [-H(+)] | cpd:C00013 | 0.22214009818922828 | 0.28281094617598 | 0.3399227597790422 | 0.4849804323093602 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 179.056 | D-Glucose [-H(+)] | cpd:C00031 | 1.6482515905428525 | 1.7462137196873047 | 1.523200838112009 | 1.0942343049391232 | 1.0034682450068266 | 0.8223948643134601 | 1.217495815772398 | 1.1082037879296296 | 0.9694516480734552 | 0.9711078092699517 | 0.9706501685819292 | 0.9960789246355799 | 1.1544854962928202 | 0.973789061846656 | 1.1155786923080515 | 1.0584280698171566 | 0.6049708486128278 | 0.7498680580131396 | 0.7541427353704666 | 0.9603600612763917 | 1.1756549143581827 | 1.031806127741038 | 1.0183978808358811 | 1.0508540941955486 | 1.080107590273652 | 1.0003448508968409 | 1.0636563034639035 | 1.3231022490700701 | 0.8491388212074646 | 0.9647162494241467 | 1.1474209009252734 | 1.289671073063837 | 1.0668316035198424 | 0.9709602048324681 | 1.2946981291592599 | 0.8484342250107664 | 1.112838801565094 | 1.2196411558368223 | 0.40772802849629325 | 0.7707426554042414 | ||||||
| 180.067 | L-Tyrosine [-H(+)] | cpd:C00082 | 0.761128070678205 | 0.8611800455779444 | 0.88221885562522 | 0.8249830068077036 | 0.9972711299414121 | 0.9212999039273014 | 1.0173616229555078 | 1.0071708780821422 | 1.0248824319954646 | 0.99764799450864 | 0.9887331214245731 | 0.952433972015827 | 1.096404856214308 | 0.8749745040833236 | 0.9928648308055289 | 1.0469310516266976 | 0.9821251469393758 | 0.8577900407912202 | 0.8716360630913089 | 0.9400415125801429 | 1.0474749327559845 | 0.9992320174816823 | 0.9833061418069232 | 1.023185514485555 | 1.0523836362844017 | 0.9863613641241188 | 1.1419201015860514 | 0.9943554346061655 | 1.1075322995445724 | 1.0381217350450527 | 1.0004676609696244 | 1.0591505719692242 | 1.0130513319280234 | 0.9396237686001947 | 0.986464039480463 | 1.0533711264458396 | 0.8827495821882182 | 0.9564753678860156 | 0.9393481991404378 | 0.8763736010935772 | ||||||
| 181.07 | Mannitol [-H(+)] | cpd:C00392 | 0.7504234141123736 | 0.852544685240531 | 0.8584254306861038 | 0.7889217472143963 | 1.0496239236387968 | 0.9697918322376032 | 1.0116838773166703 | 0.9385765287163963 | 1.0029609040948413 | 1.0250913045194585 | 1.0251428263334794 | 0.9544785276171832 | 1.0379677837535217 | 0.9483566618115548 | 0.963121212421835 | 0.9524410956381848 | 0.900947763736847 | 0.7711316434754818 | 0.8983993181266218 | 0.9961901902113891 | 1.0314294199242362 | 0.9848908588550077 | 0.9284875327013291 | 0.9356502883485855 | 0.9584796203805327 | 0.9347820920419169 | 1.1384229009046458 | 0.9894724835988133 | 0.9671477063445223 | 1.0361304468096477 | 0.9936416506515633 | 1.0531082671482366 | 1.0150423827735129 | 0.9342184445764649 | 1.0152747918877796 | 0.9713865791791997 | 0.9283680484965312 | 1.0054098783799652 | 0.9061023139661162 | 1.1871419681335234 | ||||||
| 183.067 | Choline phosphate [-H(+)] | cpd:C00588 | 0.6875330411501477 | 0.9409564895355681 | 0.9197577435786246 | 0.8723366505055704 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0970740794326612 | 1.2269465665227066 | 0.8287887646724068 | 0.9401393115298247 | 1.0160392194270385 | 1.0241782671209845 | 0.8291618196823985 | 0.9494310699590454 | 0.983878081482382 | 0.8657867560833261 | 0.9290885382861611 | 1.2036070131697445 | 0.7670938905264252 | 1.624816424318361 | ||||||
| 184.073 | L-Phenylalanine [+F(-)] | cpd:C00079 | 1 | 1 | 1 | 1 | 1.1292993192840637 | 1.0991469185736291 | 0.7673832963111984 | 0.8112442645425773 | 1.0603179004607546 | 0.8902522111727119 | 1.0011323660068745 | 1.0871646997684856 | 0.9289100929595425 | 0.9577177478855772 | 1.1136789759808474 | 1.1322390670373428 | 0.821157501101616 | 0.8628024519947617 | 0.7562520491720289 | 0.9652462881798757 | 1.0470924562206432 | 0.9472896360871346 | 1.010646953316408 | 1.1176721617664147 | 1.1344955640511327 | 1.1040598153907286 | 1.2401570678393816 | 1.156293249500839 | 1.0555158994742755 | 1.1036724851530946 | 0.942500298435165 | 0.9073267228354328 | 0.95534293050279 | 0.8115711136076831 | 0.9957489994161259 | 1.0173951866632989 | 1.041159781563338 | 1.087800398403123 | 0.8148650100546488 | 0.7573634100934543 | ||||||
| 184.988 | 3-Phospho-D-glycerate [-H(+)] | cpd:C00197 | 1.2137015724110547 | 1.3157157030400823 | 1.364608735294776 | 0.7884686778887606 | 1.1829380041862996 | 1.0281107827232643 | 0.7540419259544828 | 0.8966102234749872 | 0.8966001924823069 | 1.0986927100916914 | 0.745698002835633 | 0.8132678081780156 | 1.0132480667151216 | 0.9998015917711297 | 2.3162019626350667 | 1.2346796545501524 | 1.3351563374242958 | 0.8215601374995507 | 0.7092089502714126 | 0.8209695045845177 | 1.2614706072466724 | 1.7922774601059517 | 1.2204889805365564 | 1.0988504090521691 | 1.0921252910736459 | 0.8931992803974593 | 0.9379141803785185 | 0.9826729670236369 | 0.8595235773417396 | 0.9389919186727164 | 1.1139580095016959 | 1.1998252222432166 | 0.9663003172589814 | 0.9794563604289624 | 1.1499665445947018 | 0.8761627080882417 | 0.8614130076392256 | 1.1344268902194443 | 0.5934834890347743 | 1.761347686531933 | ||||||
| 186.058 | Pyridoxal [+F(-)] | cpd:C00250 | 1 | 1 | 1 | 1 | 1.0776923945813928 | 1.0478798633349629 | 0.883521888673035 | 0.8493748028841854 | 0.9644704711245584 | 1.0163091271391587 | 1.0802725615188753 | 0.9770246683435657 | 1.0399745997622916 | 1.0359564743109808 | 1.1165912054738074 | 1.08861287348576 | 0.8386838038418156 | 0.9029285284046893 | 0.8467402527326029 | 1.0142951808507488 | 1.1528459597365395 | 1.0490031023612232 | 1.0437453227013866 | 1.091429651041408 | 1.0911684325843598 | 1.0510520787155373 | 1.1709846429250408 | 1.051124041374066 | 0.9478598902592865 | 1.0871719305779022 | 1.035718885427919 | 1.0069449264862427 | 0.9655511052482406 | 0.9277633959982844 | 1.0170531450956621 | 0.920017870462043 | 1.0104524198674283 | 1.1117162827080467 | 0.7949322139310209 | 1.1254902017312414 | ||||||
| 193.108 | L-Arginine [+F(-)] | cpd:C00062 | 1 | 1 | 1 | 1 | 1.033631272083157 | 1.0635301106486095 | 0.8405255366073703 | 0.8943160544194493 | 0.9107645429530417 | 1.0138002183124375 | 1.0620645863823839 | 0.9918472767302309 | 0.9864998194021153 | 1.042613753638665 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.7877124619235742 | 1.770336467435407 | 0.8669421550643907 | 0.9748996039410783 | 0.9828464316820348 | 1.086602207100403 | 0.959876402363652 | 1.387043273388328 | 1.2164116337467852 | 0.7598066231990158 | 2.552623982861338 | 1.4482191223543395 | 0.7597339673369731 | 1.713647311389585 | ||||||
| 194.094 | L-Citrulline [+F(-)] | cpd:C00327 | 1 | 1 | 1 | 1 | 1.1244324662253427 | 1.1066307394091321 | 0.7738380681033327 | 0.7878609596805493 | 0.9513267306059399 | 0.9316668915195339 | 1.0673974969592925 | 1.0196833699379955 | 0.9362980332229943 | 0.9508087828416858 | 1.1386995375848796 | 1.139499895479076 | 0.8239255597747014 | 0.8104057230672821 | 0.7763061501085726 | 0.7686457394025324 | 0.969141595592309 | 0.9590222755519469 | 1.109858772827839 | 1.1398728274767511 | 1.176605132904001 | 1.144634696164054 | 1.286918631188001 | 1.1939815322965666 | 1.0183730381589302 | 1.12112797948312 | 0.9378522569597997 | 0.9521200313081155 | 0.9110517585629815 | 0.8335829947172918 | 0.9826378704068235 | 1.0391696619923887 | 0.9875180650450015 | 1.1063209383218362 | 0.7958100536899132 | 0.8391048063742954 | ||||||
| 195.029 | Ascorbate [+F(-)] | cpd:C00072 | 1 | 1 | 1 | 1 | 1.0457670893044344 | 0.9812987515639926 | 1.0019541987551543 | 0.928104592419644 | 0.9215266832280374 | 1.0463856869690158 | 1.0579910587952803 | 0.9614433311669693 | 1.0408422068099625 | 1.0928264925881757 | 1.0602609284373499 | 0.9474041884927291 | 0.702575799675722 | 0.8035056177587319 | 0.638867760035492 | 1.0538995279256245 | 1.1889428781693867 | 1.215171972851187 | 1.076110434552962 | 1.0977385976481229 | 1.0609377064097456 | 0.9753951711753468 | 0.9196656535977443 | 1.114079894890225 | 0.8569707098738644 | 0.9081480029560279 | 1.1833955364011626 | 1.3153860812942344 | 0.9573389411795402 | 1.0432167349871546 | 1.124674302574411 | 0.8497942799520397 | 1.2635204927103139 | 1.1530415759701826 | 0.5115706049190336 | 1.4727291021545907 | ||||||
| 199.002 | D-Erythrose 4-phosphate [-H(+)] | cpd:C00279 | 0.423703574036483 | 0.6060494590130489 | 0.7212807627424324 | 1.2790368310698486 | 0.9643554961005586 | 0.8797507181212993 | 1.0451116751124696 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 199.062 | D-Glucose [+F(-)] | cpd:C00031 | 1 | 1 | 1 | 1 | 0.9925308132726557 | 1.2804033311567489 | 0.4960919954456622 | 0.7450325228513288 | 0.7845982562622017 | 0.9611542673733977 | 1.2187004150996092 | 0.9461363285341851 | 0.979036781661783 | 1.221174056210096 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.1102163026398062 | 1.4121254022714862 | 0.7654232882670591 | 0.9248022779314488 | 0.9589051915852002 | 1.051975041664487 | 0.6231743025695672 | 0.8877779260323686 | 0.8285016428432597 | 0.9342784519483056 | 0.7106777303370553 | 1.2168543260810796 | 0.6669699790333986 | 1.9466484387759608 | ||||||
| 200.074 | L-Tyrosine [+F(-)] | cpd:C00082 | 1 | 1 | 1 | 1 | 1.0839433315287634 | 1.027425959483021 | 0.8983775444614998 | 0.9327303981186005 | 0.9766997227667653 | 0.9527771684393763 | 1.0942844846720932 | 1.0541780419152458 | 1.036894513343835 | 1.0101583406754753 | 1.0465285118923573 | 1.1301066163677287 | 0.8074369343871816 | 0.994063723727482 | 0.8107443195542049 | 1.1897181571389592 | 1.0786060910258777 | 1.0194056335439314 | 0.9528126036935609 | 1.0346200774119114 | 1.060572291428266 | 1.0566925062920942 | 1.1384296771188445 | 1.147915124396242 | 0.9860595207042815 | 1.0141753606413704 | 0.9496332166380486 | 1.0358833793541617 | 0.9213552832369444 | 0.8684330418507006 | 0.9841119243461878 | 0.9158108733991343 | 1.2182953449953091 | 1.1081461339598093 | 0.7417437021115453 | 1.082803328680857 | ||||||
| 201.078 | Mannitol [+F(-)] | cpd:C00392 | 1 | 1 | 1 | 1 | 1.1607289235938438 | 1.0449857269612208 | 0.8596730188667057 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.1334112630885511 | 1.0762842462966642 | 0.8282070296654366 | 0.8528970371828586 | 0.6570744514259 | 0.9213367529270917 | 1.172503850284267 | 1.151363900626352 | 1.0320271617722474 | 1.1123655003394977 | 1.2560635095328765 | 1.1215112920908195 | 1.1856694242313504 | 1.2704990367120648 | 0.9419605422730741 | 1.0543624805700487 | 1.012353825945749 | 0.9761571348017949 | 0.9302351126373064 | 0.8496104827050637 | 1.027974104637351 | 0.8846176148645102 | 1.1521435052503066 | 1.1181523205208688 | 0.7806667007786784 | 1.0177061099691116 | ||||||
| 203.068 | Choline phosphate [+F(-)] | cpd:C00588 | 1 | 1 | 1 | 1 | 1.0498714161164842 | 0.9069874310060034 | 1.0774426444566434 | 0.8418426930078616 | 1.0995275265407503 | 0.8563808638999506 | 1.0203430938136935 | 1.059676451922082 | 0.9142952757638105 | 1.0536689740104357 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.8876210533194963 | 1.1693723919619603 | 0.9463435959850764 | 0.9474715036742706 | 0.8945094612915322 | 0.7874126618409563 | 1.120176101742393 | 0.972625676922513 | 1.173742627634424 | 1.0602141941798215 | 1.0659681632628648 | 0.9585359731412582 | 1.2425305975085261 | 0.5472553466732909 | ||||||
| 203.082 | L-Tryptophan [-H(+)] | cpd:C00078 | 0.5789895008553659 | 0.7703964909570844 | 0.7883220203876516 | 0.6588086051190148 | 1.0466623314087677 | 0.8824295767867905 | 1.048163692691677 | 0.9727447597458972 | 1.0624837219610876 | 0.9732159166019269 | 0.9716937796407771 | 0.9937295569652083 | 1.11596459903795 | 0.8858300753299597 | 0.9490521414795519 | 0.9500101973496811 | 0.9713005828759766 | 0.7639684437715096 | 0.895743095166626 | 0.9803660301277068 | 1.0195762208086654 | 0.9898583984954984 | 0.9394970567894814 | 0.9579014750599886 | 0.9986577750392729 | 0.9293575792587785 | 1.1763003184022023 | 1.0364762502239282 | 1.117979200140896 | 1.055005133458972 | 0.9677958849452836 | 1.0024887426462885 | 1.011390032903861 | 0.904370447880068 | 0.9817383693860047 | 1.060508660418618 | 0.9659981447726816 | 0.9851392496325626 | 0.990526191000839 | 0.9121604012516897 | ||||||
| 204.053 | Lipoamide [-H(+)] | cpd:C00248 | 0.735219379678971 | 0.8627234469934142 | 0.8239808218558895 | 0.9413112106165414 | 1.0524923440246579 | 1.0191338216056482 | 0.9388519312155948 | 0.9323243327242476 | 0.9320003725485927 | 1.007044925564353 | 1.0498275779961286 | 0.9761834120151488 | 1.0646946049860788 | 1.040289917739089 | 1.1245026376160197 | 1.0114330299846193 | 0.8464357552093936 | 0.9509729950139318 | 0.7271192787265754 | 1.1854110350986693 | 1.150700076229668 | 1.021347940681255 | 1.0222698727234634 | 1.0334476763824452 | 1.1685957578506583 | 1.037970165074795 | 0.917096961305824 | 1.2234349259106732 | 0.8470830099385204 | 0.9659513089851294 | 1.0127229857036084 | 1.0556375656607713 | 1.009242820506952 | 1.0383273093453385 | 1.006259868544217 | 0.8269699707480108 | 1.1610316204654814 | 1.092622566700181 | 0.9196916349377706 | 0.9828121497992323 | ||||||
| 206.068 | Dihydrolipoamide [-H(+)] | cpd:C00579 | 1.022817655632232 | 1.2299242800116112 | 1.3583920114089576 | 1.2970385675587792 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0158947682096193 | 1.18596484563342 | 0.9781187286193495 | 1.0586132948672005 | 0.9980174988666115 | 1.033539495287098 | 1.0034586424638292 | 0.9937802120326754 | 1.1095282813188871 | 0.9506721260714066 | 1.2130959947958189 | 1.0735244981663452 | 0.8736770916733544 | 0.8978205235954168 | ||||||
| 213.015 | 2-Deoxy-D-ribose 1-phosphate [-H(+)] | cpd:C00672 | 1.4791671822908439 | 1.4900248195401338 | 1.570598707565294 | 1.33565146023799 | 1.0518495284089167 | 1.236406331181751 | 0.833893050817692 | 1.056075787200585 | 0.9834536662950807 | 1.0859564544854696 | 1.4951620046712912 | 0.990293033839864 | 1.0039823473251834 | 0.9660685105628228 | 0.8832555551619395 | 1.0702110540316265 | 1.3448279713102567 | 1.0795571409257987 | 1.2160756220102444 | 1.0551057267051076 | 1.132926086903326 | 1.0102981472011003 | 0.9360349987380938 | 1.1424074457726678 | 1.0902262453931408 | 0.9505375445699772 | 0.7740646838011777 | 1.334757260681966 | 0.9461596917570145 | 0.9263573816634475 | 0.993458341836784 | 1.032477258599081 | 1.0634701899659116 | 1.021535289738742 | 1.1024097691456545 | 1.1735366996662593 | 0.9987181094102343 | 1.0179094672544609 | 0.8463926102368292 | 1.1934612217475153 | ||||||
| 223.086 | L-Tryptophan [+F(-)] | cpd:C00078 | 1 | 1 | 1 | 1 | 1.1444579624008309 | 1.050516905734592 | 0.901835696975293 | 0.8461178916867774 | 1.0534739290719808 | 1.0306183131803406 | 0.9796835697558621 | 1.046708491536936 | 0.9728798949194821 | 0.932025183063026 | 1.1483119501518253 | 1.1296969359607834 | 0.9380795998344974 | 1.1086534439820146 | 0.7216288014905144 | 4.078202276574783 | 1.0564929745008202 | 1.0134486807040761 | 0.9949510402617828 | 1.1010079331137645 | 1.1958382885399284 | 1.0177333265971504 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 224.057 | Lipoamide [+F(-)] | cpd:C00248 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.8923199867835214 | 0.9107339767305919 | 1.0302667529500966 | 1.0113565616198308 | 1.0070125831812675 | 1.1178408128347923 | 1.0922512203749415 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0725115746800686 | 0.8970281188125363 | 0.7220303917333954 | 1.0265514279533268 | 1.1448588628262841 | 1.3099069685849563 | 0.6928094676589658 | 1.148888418817798 | 0.867990644313147 | 0.7218501370056157 | 0.6935636115131153 | 1.013295567067446 | 0.6702549540736372 | 1.5585034759150247 | ||||||
| 226.071 | Dihydrolipoamide [+F(-)] | cpd:C00579 | 1 | 1 | 1 | 1 | 0.9880616088901896 | 1.0838752140627859 | 0.8635030137751825 | 0.8654123393585171 | 0.9344510690204291 | 1.035347480422831 | 1.0162856219808956 | 0.9601669785251659 | 1.09766855429742 | 1.007171965046109 | 2.334766572571764 | 1.034092256013049 | 0.9819998051872822 | 1.0529334481124892 | 0.8391968816023773 | 4.935762043110276 | 0.9647954345186722 | 1.1154233267036904 | 0.9876252725031186 | 1.032312483770098 | 0.9074507968691704 | 0.9608152689972271 | 1.116353633901677 | 1.0178205920414714 | 0.8762714949047832 | 1.0266526006872565 | 1.069419863187483 | 1.1342120153444986 | 0.8693224287806636 | 1.0035758239586852 | 0.9501742580505845 | 0.8154751071033197 | 1.0101186969512783 | 1.0667269005104008 | 0.7493338891616809 | 1.2797714992428528 | ||||||
| 226.084 | Deoxycytidine [-H(+)] | cpd:C00881 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.85441118462405 | 1.0563684250330727 | 0.9890897162253108 | 0.9992393985453837 | 1.0085578968575086 | 1.0323471646347344 | 1.000787705388512 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 227.067 | Deoxyuridine [-H(+)] | cpd:C00526 | 0.8002651673635081 | 1.0286859227478216 | 0.9680953373634235 | 0.7896248072493033 | 1 | 1 | 1 | 0.8859681891608159 | 0.9594438091135449 | 0.9700099606985417 | 1.1135079075300238 | 1.008169914329687 | 1.0140931637286 | 1.0360154201158176 | 1.1809475938794163 | 1.046201118373739 | 0.791556555719774 | 0.9590559839086396 | 0.841089366518123 | 3.045797246231538 | 0.9965591104621101 | 1.1064736362325098 | 0.9652083153943055 | 0.9576798450083964 | 1.0366385860257343 | 1.00141198978503 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 229.012 | D-Ribose 5-phosphate [-H(+)] | cpd:C00117 | 1.0200293646156822 | 0.7652754488865509 | 0.6051231679001766 | 0.33476945985738477 | 1.1229007613838908 | 0.8742929298359959 | 1.200376800640618 | 0.8761436327929327 | 0.8504507957038492 | 0.940006189866684 | 1.763258382177852 | 0.8235659403101034 | 1.055705320374532 | 0.8338198087582499 | 1.0257836285942645 | 1.3580264733085377 | 0.5717900039269007 | 1.113658730023839 | 1.6242479989529814 | 1.589885837297486 | 1.1700071935448146 | 1.043207067003099 | 0.7633434858647901 | 0.7916391174661435 | 1.1843783331554347 | 0.8523874807885053 | 0.9693736536720218 | 1.1399194411211975 | 0.7998240066950824 | 0.9186870003295585 | 1.003808595836493 | 1.0550689909680955 | 1.086269741194678 | 0.8302301423908064 | 0.9544348959019766 | 1.1440044437498418 | 1.1143453063221904 | 1.0795204888843664 | 1.0498922868398042 | 0.8515552618734895 | ||||||
| 241.086 | Thymidine [-H(+)] | cpd:C00214 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.935790779321627 | 1.0324068963530633 | 0.9284068403413447 | 0.9335114280339868 | 1.0440771910124584 | 1.0504494901277868 | 0.930174562716176 | 1.169463364737343 | 1.3155949988849878 | 0.7322455142659515 | 0.8954522521173465 | 0.8227572455302014 | 0.48463160341696376 | 1.0950018640312702 | 0.9405296456310231 | 1.071676659832907 | 1.1068361037680796 | 1.2696648954696055 | 1.2292632756569126 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 242.079 | Cytidine [-H(+)] | cpd:C00475 | 0.8343343478162147 | 0.8163676927805993 | 0.8075013750083392 | 0.7619465895420291 | 0.9857730839046013 | 1.0040374274052875 | 0.9712295983755953 | 0.9798400972639404 | 0.9841495886566937 | 0.9852048521587496 | 0.9540198348320732 | 0.9680701416844166 | 1.098873207677738 | 0.9556319250608917 | 0.994877787774228 | 1.1003917526753326 | 0.6011972752337422 | 0.8403011570826143 | 0.7363864854400807 | 0.9602851355575949 | 1.0732835518533494 | 0.8260218622318636 | 0.9993790635317519 | 1.0507573387611346 | 1.150137682356273 | 1.0962136496414476 | 0.9907124860970262 | 0.787314046197516 | 1.0164368834435322 | 1.1379506891468711 | 1.1007331446925228 | 1.1912582589101348 | 1.0177489430137343 | 1.011222471135835 | 0.9706880113992786 | 0.8793160608109221 | 0.8766665127754503 | 0.8920285735902354 | 0.8533087320649351 | 0.7373483834554944 | ||||||
| 243.063 | Uridine [-H(+)] | cpd:C00299 | 0.567454092661877 | 0.564573845682913 | 0.609975138403897 | 0.6428126972500128 | 1.006344566556847 | 0.8672682927300619 | 1.1470854948358196 | 0.9439391678703966 | 1.0795775069862104 | 0.9725664916914124 | 1.0151212999077757 | 1.0937186816951752 | 0.9616493952250713 | 1.1025120341478738 | 1.2075174069395203 | 1.1028422455725482 | 0.7547994243258893 | 0.83573495206094 | 0.9326775041270472 | 1.1759883401832254 | 1.07905267091206 | 0.9082404219417888 | 0.8993070011556223 | 0.9819122534410348 | 1.0747066769429932 | 1.1124123912704083 | 1.291331484893537 | 0.9521003842422703 | 1.0118632683815916 | 1.0008138042439432 | 0.9977262311910443 | 1.0454490198082795 | 1.0635418947780535 | 0.9747292352672736 | 1.0760490526198467 | 0.9884192397010504 | 1.0760760161525844 | 0.8679395899491551 | 1.0660037883590594 | 0.7232590095442802 | ||||||
| 246.015 | Pyridoxal phosphate [-H(+)] | cpd:C00018 | 0.7951333529667196 | 0.9808302472300378 | 1.0525572208450387 | 1.2148992638556158 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.2764821637115897 | 0.7160496763055149 | 0.8540613370725458 | 1.1958252277187378 | 1.3277867207327818 | 1.5162314101848324 | 0.8525671971092943 | 1.0785553793535387 | 0.9254105797985822 | 0.758585992990163 | 0.9762325750773668 | 1.0935204743774558 | 0.506052372234468 | 1.4701257870388353 | ||||||
| 246.088 | Deoxycytidine [+F(-)] | cpd:C00881 | 1 | 1 | 1 | 1 | 1.1120593509813848 | 1.0643405960571528 | 0.8613946751109848 | 0.9199804816089886 | 0.9856678483453808 | 0.9506745030253795 | 1.0507300637588122 | 1.0714124690605422 | 0.9661293685573549 | 0.9972139625897066 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.170273833784727 | 1.0702378506657753 | 1.00771323910257 | 1.0750646086786078 | 0.9933728872283678 | 0.946836131006888 | 0.9626685715187228 | 0.8676309716626509 | 1.0731762362878143 | 1.0002938628060694 | 1.0745525291159015 | 1.0906437159650653 | 0.8614737770720542 | 0.8627682253400265 | ||||||
| 250.094 | Deoxyadenosine [-H(+)] | cpd:C00559 | 1 | 1 | 1 | 1 | 0.9806998437978407 | 0.9226598747558986 | 0.9848589647523509 | 1.101523980537911 | 0.58138280790684 | 1.2832848708633737 | 0.836211527692744 | 0.6206761570066218 | 1.532751435827153 | 0.9912111904156667 | 0.8082940883174871 | 1.1260575319861066 | 0.7108932754386272 | 1.5748582891226643 | 1.1719089388468729 | 1.5473005643713456 | 0.798088674295765 | 1.0282635155953288 | 0.9900001094694648 | 0.9952875535755771 | 0.9433833148456684 | 0.8626151130953146 | 1.3070796559341251 | 0.24102810051154563 | 0.6501161491101889 | 1.478076653595171 | 1.692357137133901 | 2.176425472684089 | 0.725611016453546 | 1.5792223978628317 | 0.7227256338120115 | 0.4769832941682363 | 0.8758111352697051 | 1.0524167702644012 | 0.264212161548453 | 0.8127937622663902 | ||||||
| 257.104 | sn-Glycero-3-phosphocholine [-H(+)] | cpd:C00670 | 0.93508865280033 | 1.1126866348818976 | 1.243167133290998 | 0.994758590243059 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||
| 259.024 | D-Fructose 6-phosphate [-H(+)] | cpd:C00085 | 0.7617415237620774 | 0.6637565114800108 | 0.6561560189557547 | 0.5278942634035362 | 1.1446405682164211 | 1.3375018599857151 | 0.9038683630422409 | 1.0303548895089745 | 0.8856340927406872 | 0.8758710155096049 | 0.8881006742967001 | 0.7659031367327938 | 1.258330139855679 | 0.9895740804838893 | 0.93263421314894 | 0.9796552796427693 | 0.9599215352881635 | 0.7922336845316652 | 0.6814878700422817 | 0.5486706821588122 | 1.2515387894968124 | 1.2546287865635113 | 1.2490839949858366 | 1.0868763473033571 | 1.1535452085237201 | 0.9799311910520146 | 0.7654723558650324 | 0.9447447703867362 | 0.9496224850327779 | 0.9703837867510279 | 1.1623368552997335 | 1.2275006630629464 | 1.1088844870703722 | 1.065248206762417 | 1.1896344100413665 | 0.8904424235151888 | 1.0600413899854886 | 1.1690199055069168 | 0.5974140806987471 | 1.3081140422024313 |
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| # Standard Deviation of the fold change values, corrected using median metabolite fold change values per batch | |||||||||||||||||||||||||||||||||||||||||||||||||
| Geometric standard deviation assuming normality of log values. To get absolute values mean*2^(log2(1+-SD)) | M129_timecourse_6h_3 | M129_timecourse_24h_3 | M129_timecourse_48h_3 | M129_timecourse_96h_3 | 24h_timecourse_4 | 48h_timecourse_4 | 6h_timecourse_4 | TF173_MPN303_5 | TF178_MPN250_5 | TF187_MPN674_5 | Tn051_MPN051_5 | Tn674_N/A_5 | WT_WT_5 | dldh,NoxE_N/A_5 | AA_perturbation_6 | Fe_perturbation_6 | Glu_perturbation_6 | Gly_perturbation_6 | KO51_mutant_6 | Ox_perturbation_6 | TF173_mutant_6 | TF183_mutant_6 | TF414_mutant_6 | TF462_mutant_6 | TF463_mutant_6 | Tn674_mutant_6 | blank_control_7 | Gly_ctrl_perturbation_7 | TF173_mutant_7 | TF178_mutant_7 | TF184_mutant_7 | TF187_mutant_7 | TF413_mutant_7 | TF462_mutant_7 | TF463_mutant_7 | Tn051_Gly_perturbation_7 | Tn674_mutant_7 | WT_perturbation_7 | WT_noGluc_perturbation_7 | water_control_7 | |||||||||
| Batch | 3 | 3 | 3 | 3 | 4 | 4 | 4 | 5 | 5 | 5 | 5 | 5 | 5 | 5 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | |||||||||
| m/z | metabolite | KEGG ID | |||||||||||||||||||||||||||||||||||||||||||||||
| 59.015 | Acetate [-H(+)] | cpd:C00033 | 0.010422359448373136 | 0.12478569461208033 | 0.3139648950727054 | 0.19525435786682718 | 0.31420541936005697 | 0.2567625163539551 | 0.18953077036862737 | 2.3406635272921276E-4 | 0.536653409599258 | 0.20716782465966277 | 0.3172759577484522 | 0.43250050004559853 | 0.2828688445921118 | 0.4450128216014907 | 0.1915522731973044 | 0.2230672076963204 | 0.14421255195346064 | 0.13787710342993265 | 0.18259767485244296 | 0.16367475329120756 | 0.16176823513891012 | 0.295888727724913 | 0.3301524901800953 | 0.24060179169989637 | 0.1049093640750543 | 0.029332397417342414 | 0.22278334033323524 | 0.2511090213316432 | 0.15665950980213464 | 0.1619286433736492 | 0.0523741206325975 | 0.13286255683589918 | 0.4599985254919134 | 0.22790937670716302 | 0.5967861214210386 | 0.09179121840539753 | 0.06889346812800912 | 0.36576628036707043 | 0.0700850426335601 | 0.12410195869402284 | |||||||
| 74.026 | Glycine [-H(+)] | cpd:C00037 | 0.17525997611883246 | 0.054990376800221265 | 0.5614471529912257 | 0.2263681677356793 | 0.11603841235803258 | 0.15640240828097715 | 0.14975288122558575 | 0.009911904970231271 | 0.05514608710580275 | 0.10101228655807888 | 0.21639974792279562 | 0.03229629087490771 | 0.09737007765710433 | 0.24810948574320274 | 0.13111843534061043 | 0.10407492536145976 | 0.12827661237826612 | 0.14331407639972787 | 0.2239279588077284 | 0.2775860028393048 | 0.1984846220409685 | 0.06565081847657062 | 0.03940364803959378 | 0.16264700728782405 | 0.032882858606628 | 0.15581177694297346 | 0.126711765822485 | 0.28597020581800475 | 0.18526879634156784 | 0.11860771255105124 | 0.10919296774345073 | 0.2479145021335068 | 0.1940685788777726 | 0.14879002726432275 | 0.18058809627303693 | 0.13135848528363714 | 0.1431312510998628 | 0.15998004753985165 | 0.23188930573426803 | 0.2568994553875161 | |||||||
| 87.007 | Pyruvate [-H(+)] | cpd:C00022 | 0.023572838222344735 | 0.20678413118936997 | 0.5818903979115756 | 0.641954640683848 | 0.5890091384458853 | 0.2424332406423986 | 0.597940904647548 | 0.15622298044352484 | 0.09323093684180385 | 0.19520200264626764 | 0.11356471451851365 | 0.10921326243227017 | 0.22901365643489027 | 0.18845314822671713 | 0.1612195188882726 | 0.07069085528282776 | 0.14736920341685983 | 0.0682685365056386 | 0.20010047984089688 | 0.07915348554525355 | 0.1885355883848589 | 0.23714738338625788 | 0.15993912014900805 | 0.17840248754933594 | 0.031278127727150315 | 0.041535041578363754 | 0.1807217436599648 | 0.0497456408003661 | 0.30211056291324523 | 0.2724099444679927 | 0.022482886559768087 | 0.2128203468963732 | 0.4363270062350722 | 0.1495694979119514 | 0.4389070386908259 | 0.2321458830044049 | 0.02271091014204241 | 0.4338394656553729 | 0.12199420048557284 | 0.19472787603335884 | |||||||
| 88.041 | L-Alanine [-H(+)] | cpd:C00041 | 0.094532640264773 | 0.014218039524281781 | 0.3150684690529941 | 0.48065398460502984 | 0.3255693084135713 | 0.1908512961839228 | 0.23541829981054893 | 0.08476835720301613 | 0.2947839350761825 | 0.22039082602765647 | 0.15729194319472942 | 0.43438109506995715 | 0.268977142768395 | 0.22486182859465298 | 0.03901633029000482 | 0.05106141760484644 | 0.07890977269420522 | 0.053326286125777084 | 0.1667029796321941 | 0.11588113917272355 | 0.06327025311337404 | 0.045027924151976886 | 0.06076063074261546 | 0.056150725194876995 | 0.02165479048019098 | 0.041278640754228955 | 0.11425670512480346 | 0.03811603710500128 | 0.04622317222454939 | 0.03666094531760349 | 0.043392807517939086 | 0.026718038460841417 | 0.04759517978651745 | 0.05730122190635163 | 0.13078517859190736 | 0.042537723179462 | 0.061515566449890945 | 0.05390583526339836 | 0.012832613750066144 | 0.011060822900186288 | |||||||
| 89.026 | Glycerone [-H(+)] | cpd:C00184;(S)-Lactate [-H(+)];D-Glyceraldehyde [-H(+)];cpd:C00577;cpd:C00186 | 0.144921560331989 | 0.19428592555765997 | 0.5517505365119423 | 0.6291806497636199 | 0.09883265116856711 | 0.14936646512588259 | 0.0995909591547794 | 0.14130182599567037 | 0.33623995753004676 | 0.17609499571088885 | 0.20137324981538474 | 0.2648264076999772 | 0.3378002073072581 | 0.46471106712237675 | 0.07069300933831259 | 0.07953832130780152 | 0.08686103357763093 | 0.01737944131302667 | 0.3850611590300118 | 0.14112399351457586 | 0.14678713734222396 | 0.11598585766498926 | 0.08407001623746876 | 0.1303485363407426 | 0.06509446072107902 | 0.10491633736028777 | 0.2068467494355185 | 0.17816708615589621 | 0.0690077406137103 | 0.18011734939783733 | 0.12746374936256563 | 0.14570084775739126 | 0.24342604665862802 | 0.17622273683831063 | 0.4482198972124508 | 0.17649426354890121 | 0.4092918304250624 | 0.3887204421011467 | 0.06861499286202559 | 0.014060660977696487 | |||||||
| 91.04 | Glycerol [-H(+)] | cpd:C00116 | 0.27379670718858823 | 0.21472542613017298 | 0.1438249008428967 | 0.073410124177824 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.070724873669433 | 0.1937065159191247 | 0.26505015764011924 | 0.6789281944377187 | 0.3558260083218391 | 0.09272218514834442 | 0.05223512471484685 | 0.2808301798559858 | 0.18586628358282287 | 0.41582721229235675 | 0.35815187851450625 | 0.24553704550986058 | 0.32199999761264686 | 1.1180159526135824 | 0.26842608946492647 | 0.6914651276088198 | 0.4482088942516796 | 0.0996852019755353 | 0.35434964884463527 | 0.09045492640639569 | 0.48877322619492986 | 1.6151296311302006 | 0.9455147832426626 | 0.5114335070006377 | 0.22240046063326646 | 0.09749713781535428 | |||||||
| 94.03 | Glycine [+F(-)] | cpd:C00037 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3523356481417159 | 0.40353500545757076 | 0.35908793386467835 | 0.17783364479568795 | 0.5355238473615628 | 0.4030847188634289 | 0.3006886873001159 | 0.11400576333015999 | 0.22257964459833285 | 0.04731327764359736 | 0.26360786172412337 | 0.2326836131390752 | 0.19914243507977905 | 0.019359991855332506 | 0.3245974303957595 | 0.33482585423904143 | 0.2663576534055361 | 0.03707568431602222 | 0.04831743469980727 | 0.5463069628780066 | 0.4905136491610809 | 0.46798119560305373 | 0.48953124875437215 | 0.3215893228843946 | 0.12430468676391856 | 1.3064312008229453 | 0.4178709768382254 | 0.5564525838928488 | 0.53191220406864 | 0.09484802928818202 | 0.08823122349495659 | 0.12560775893638548 | 0.3835365988741363 | |||||||
| 96.97 | Orthophosphate [-H(+)] | cpd:C00009 | 0.17812801660193583 | 0.30389742739364384 | 0.22449664002787564 | 0.3940012019326883 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.04256236664951486 | 0.014353063064127534 | 0.05264783188112539 | 0.05118225063642962 | 0.22025716790359165 | 0.2763734837451712 | 0.05739413928205459 | 0.12221600295875605 | 0.088770243568956 | 0.06185928784496783 | 0.02743440192187765 | 0.03152235081499938 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 104.036 | L-Serine [-H(+)] | cpd:C00065 | 0.08261047962403997 | 0.10771081067364358 | 0.06973228404812966 | 0.33345014744443996 | 0.12187093992481027 | 0.14025669948990382 | 0.12183501590500725 | 0.17314387612868307 | 0.11427769709932566 | 0.16617041185363302 | 0.22739263950636282 | 0.11415890012728966 | 0.3019507701559248 | 0.45274102132048744 | 0.14845053658400773 | 0.1837008904634308 | 0.05344662378828898 | 0.13519697449643406 | 0.20662398448428856 | 0.09264241644896018 | 0.07861949999338033 | 0.03589288659554661 | 0.0678523886957859 | 0.15994423641160027 | 0.08371008876122389 | 0.015550930345375993 | 0.12205645757601728 | 0.04515039864524588 | 0.07469215947350816 | 0.1265682377949595 | 0.03911474773422515 | 0.10258640694509151 | 0.10723832455772124 | 0.12068003949290725 | 0.3624183234477206 | 0.02564652548354892 | 0.31646855237259247 | 0.19580007715460196 | 0.18175843643649378 | 0.22657936327040815 | |||||||
| 107.013 | Pyruvate [+F(-)] | cpd:C00022 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3110158466362619 | 0.17979288380469516 | 0.19983232377051785 | 0.1491020412107638 | 0.19197390666187322 | 0.21712953161158333 | 0.25638077606335874 | 0.032975143006997124 | 0.393516313254909 | 0.15433154196129162 | 0.03621144750880674 | 0.3069434063799992 | 0.021704404606133713 | 0.017155998208072704 | |||||||
| 108.046 | L-Alanine [+F(-)] | cpd:C00041 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.1370608597755405 | 0.26279501567108837 | 0.048966663191131854 | 0.09234569092457194 | 0.15433072036810516 | 0.14261750920939803 | 0.10027849968650074 | 0.3148671897163048 | 0.27992393896324747 | 0.30977894725604477 | 0.0201400316366155 | 0.31152716330368196 | 0.24605124806463866 | 0.03665353913564721 | 0.1416728891203553 | 0.4805589851155182 | 0.12169057297662397 | 0.3026823890270948 | 0.9096147810067854 | 0.09651062433108093 | 0.39059040670919315 | 0.3229635089491801 | 0.3492199957644725 | 0.48814795536920064 | 0.07274229273596731 | 0.2310701626469709 | |||||||
| 109.03 | Glycerone [+F(-)] | cpd:C00184 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 9.42055475210265E-16 | 0 | 0.192640241087421 | 0.14930013975391362 | 0.07195516161667635 | 0.08180760288561799 | 0.34518876782689367 | 0.04677999139976147 | 0.14566101540568305 | 0.36179036563378386 | 0.28504908210457847 | 0.18405340779859594 | 0.04665586934416262 | 0.12690727167522273 | 0.24808912156569504 | 0.05986511809622349 | 0.13159424585847368 | 0.4874775884906531 | 0.22603054041547604 | 0.34919809796377316 | 0.6946831202135554 | 0.1090481123178168 | 0.4598363286275444 | 0.22936082895386495 | 0.5373288237813475 | 0.5085258704363791 | 0.0957818973523852 | 0.21599699084172946 | |||||||
| 111.02 | Uracil [-H(+)] | cpd:C00106 | 0.17922941652317964 | 0.16166826486099264 | 0.18747173730889952 | 0.14949344655143149 | 0.08316884990211643 | 0.15494184478437564 | 0.06684948139404119 | 0.16930995429393236 | 0.13515664872401775 | 0.6362674223792956 | 0.1488077526466189 | 0.2784063357403261 | 0.17701208201960208 | 0.1655231593538162 | 0.10383144234505064 | 0.022455352614782834 | 0.10059204211679965 | 0.016646451883141268 | 0.25385759755697646 | 0.12979424632309086 | 0.09388007603861034 | 0.15698393960749737 | 0.02674984955166856 | 0.14565717774837067 | 0.08338237022367273 | 0.005692646505784573 | 0.172516621878581 | 0.11489925823225683 | 0.08065135585196218 | 0.16574549026765137 | 0.10009311287786353 | 0.18434562504769286 | 0.06983911051284461 | 0.04528155756255756 | 0.12784414208053518 | 0.14716195509730012 | 0.15713465683959132 | 0.3077080919069069 | 0.2615578771068171 | 0.12199431294298459 | |||||||
| 111.045 | Glycerol [+F(-)] | cpd:C00116 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.2435286910645685 | 0.02666007623295446 | 0.1621794625308197 | 0.41065482157663374 | 0.2479035169645688 | 0.32680909665128777 | 0.6195277831777874 | 0.04214158617949569 | 0.43244401205188554 | 0.2889949866946224 | 0.46352240522561633 | 0.6173646081203935 | 0.19367604339427605 | 0.16633130278177094 | |||||||
| 114.056 | L-Proline [-H(+)] | cpd:C00148 | 0.05453733902404231 | 0.139335391363308 | 0.2899969058488998 | 0.435750941305573 | 0.26822628970676204 | 0.2674445262869151 | 0.1749940158442365 | 0.1218725771965594 | 0.41774116579661164 | 0.1295698165180064 | 0.16748251826519578 | 0.1399952390644696 | 0.27142248167139393 | 0.12131679371089892 | 0.22491209660304742 | 0.10764619645246391 | 0.1429196026747631 | 0.09249039937071862 | 0.1665595670581646 | 0.03292762941692706 | 0.17766244263506292 | 0.23636733729236956 | 0.25390875839172244 | 0.15358505283733026 | 0.09444916490194724 | 0.09399994403583256 | 0.04037286789042541 | 0.0691369949262125 | 0.18708310810932632 | 0.07295813950005228 | 0.07421337315465538 | 0.10413735359128135 | 0.14901446950043748 | 0.1851472400801354 | 0.38618099102768133 | 0.09712528328935431 | 0.11745087208770001 | 0.252441285499417 | 0.1979546574012849 | 0.017014641864385872 | |||||||
| 116.072 | L-Valine [-H(+)] | cpd:C00183 | 0.047768747312782175 | 0.04987159458876347 | 0.07551106807758927 | 0.22747070760569804 | 0.12203462643513886 | 0.12503495148477578 | 0.10615787955103884 | 0.032495053110277075 | 0.13216015811538812 | 0.1048763599827846 | 0.0884996097257017 | 0.037705216675622065 | 0.06866617302729613 | 0.019990466907698186 | 0.02239843795185041 | 0.057114165599749585 | 0.033427382002858184 | 0.11278328442747194 | 0.0714014769615482 | 0.015661637788494272 | 0.04450145762917944 | 0.004456776696200864 | 0.028874189777569153 | 0.016367370215338784 | 0.059862083534366506 | 0.036856801985463775 | 0.07168246034582719 | 0.056878439615979805 | 0.034996446365243225 | 0.042603938676481955 | 0.03830397323001361 | 0.0514885930700832 | 0.06142655784918076 | 0.062443438265978285 | 0.018408607010969247 | 0.0850799495617534 | 0.14354393308960617 | 0.07368094183126328 | 0.040803987160667264 | 0.042977704490889966 | |||||||
| 116.973 | Orthophosphate [+F(-)] | cpd:C00009 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.03499099179039141 | 0.4487771777006215 | 0.1440877562281774 | 0.09237662616472966 | 0.2306354450143706 | 0.2551588738753803 | 0.21783024826144184 | 0.20408550467773617 | 0.07493308952217988 | 0.26553386562669695 | 0.2697466609464314 | 0.14167475257925322 | 0.1519574095833065 | 0.15181100189693086 | 0.10242939134820218 | 0.07955059809437649 | 0.09814313070789968 | 0.09052217487733055 | 0.22308133643178743 | 0.28248221809658 | 0.1856688687106967 | 0.35149463878045967 | 0.11633422707923641 | 0.35307888704827367 | 0.42241382262782495 | 0.3202497181726858 | 0.1340741973972593 | 0.2602311933156481 | 0.18449509116322094 | 0.8922856687624119 | 0.19819761683309148 | 0.10156903134341376 | 0.7011881521181298 | |||||||
| 118.051 | L-Threonine [-H(+)] | cpd:C00188 | 0.05323581799721832 | 0.07985079375070982 | 0.10434739731021815 | 0.2758730795238468 | 0.11885408327504703 | 0.08674131679522852 | 0.12158293396717823 | 0.16130687268678157 | 0.01690988874634449 | 0.07875328092830396 | 0.11128125875494452 | 0.026400365007651586 | 0.14904526758728798 | 0.14583279595698787 | 0.1549372477455951 | 0.19956912680364478 | 0.06901163619971327 | 0.05307585772609376 | 0.24219204219281654 | 0.10888588288551869 | 0.11121196823618139 | 0.023531027066266835 | 0.04650921167235495 | 0.11506422793465766 | 0.0462552754160356 | 0.05608290582227238 | 0.10237231708958848 | 0.1451262618109754 | 0.07189324956333887 | 0.12455884535158367 | 0.10746311127464038 | 0.06254219330004997 | 0.10384928018625571 | 0.14357427879385423 | 0.2771936052130762 | 0.030207012930950544 | 0.13829608266905413 | 0.174774531629966 | 0.10563975679895873 | 0.08200062253467505 | |||||||
| 120.012 | L-Cysteine [-H(+)] | cpd:C00097 | 0.24588040298053784 | 0.22886463755512843 | 0.023770875713891436 | 0.26709091430912907 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.04629461545789495 | 0.345038380224647 | 0.027282915376397814 | 0.06740638896366481 | 1.413773233672452 | 0.39595522367751484 | 0.18433076739826937 | 0.001867846568191249 | 0.586366787961052 | 0.43065849358386493 | 0.6328467930824542 | 0.5576129992806624 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 122.025 | Nicotinate [-H(+)] | cpd:C00253 | 0.0479033041583899 | 0.2705504292654624 | 0.12733284608666318 | 0.30409195810275824 | 0.08291670047243278 | 0.10965428445847727 | 0.18925178116528096 | 0.1128866227783971 | 0.24206745202485327 | 0.3934603114569561 | 0.18533419941263993 | 0.24135129837719804 | 0.33715880706040025 | 0.24881524982222553 | 0.10715640281962045 | 0.10201536447363149 | 0.09391373785270304 | 0.16079488403664077 | 0.15813818629149848 | 0.14545821159883118 | 0.07662544807459189 | 0.15563699696463484 | 0.22250060604816888 | 0.18354156476258274 | 0.04131376203471934 | 0.029945562430230825 | 0.3854888363809339 | 0.319943213544876 | 0.328625888258627 | 0.4310744750003854 | 0.19902197774658278 | 0.17680096352740407 | 0.807071901849342 | 0.2982978253319497 | 0.4599384415443026 | 0.42097710721300136 | 0.17808258655093123 | 0.2019553586398843 | 0.06687286911671833 | 0.24447410372581627 | |||||||
| 124.04 | L-Serine [+F(-)] | cpd:C00065 | 0 | 0 | 0 | 0 | 0.11420137676347575 | 0.11189188030299323 | 0.2415008341378009 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.11291471842504058 | 0.23385441294686055 | 0.08679350892063876 | 0.14965741636870825 | 0.25619531711920174 | 0.31271463506417085 | 0.24281302428646062 | 0.3462926994975932 | 0.33369495272159494 | 0.2004877799925264 | 0.07118722343341097 | 0.0742072199331646 | 0.40118627001284624 | 0.33861007563117707 | 0.3642166494986603 | 0.5083644802558028 | 0.20461396000055157 | 0.22913465662980173 | 1.2685394578400306 | 0.32121148785557 | 0.4508087110474504 | 0.4167250975847235 | 0.2132804582995488 | 0.2604319906857615 | 0.0639202223992565 | 0.2955435870376828 | |||||||
| 125.036 | Thymine [-H(+)] | cpd:C00178 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.16358602952075815 | 0.19633334747185432 | 0.13924147471253726 | 0.18088479893400383 | 0.2335432329065452 | 0.0874654242861587 | 0.07968628027567376 | 0.12277726123818879 | 0.05724616554728821 | 0.1835323140752426 | 0.07797314182821985 | 0.03342710677278358 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 130.087 | L-Leucine [-H(+)] | cpd:C00123 | 0.057499238254706826 | 0.027732689275722408 | 0.04197827061236398 | 0.05024756639605809 | 0.04466712308132669 | 0.07635813348535742 | 0.01861869954123497 | 0.011368358448370716 | 0.05042686446607205 | 0.1111974878978975 | 0.07572273740946023 | 0.040281695125149286 | 0.041532014305215026 | 0.03691234313419741 | 0.01119619433796859 | 0.029651764566401825 | 0.018268852690850892 | 0.03423487474913343 | 0.06426961009777571 | 0.043433165954485826 | 0.012909814164687897 | 0.0194532340063546 | 0.013674697679603874 | 0.014154307893867174 | 0.01828437956254237 | 0.002235957638038939 | 0.019620889624570655 | 0.06208013198063333 | 0.03171169251453956 | 0.022653735330680772 | 0.02518153670238562 | 0.01732053211526776 | 0.03239059885878748 | 0.04814286739670706 | 0.05236019289521517 | 0.03870105130590564 | 0.060549345534923533 | 0.013962119328115568 | 0.02283207442722401 | 0.01878447047698391 | |||||||
| 131.045 | L-Asparagine [-H(+)] | cpd:C00152 | 0.3631568688228404 | 0.23867655830498258 | 0.13133950360777244 | 0.6969663541799045 | 0.06505495077724378 | 0.11583134404815125 | 0.0588974206138055 | 0.21386434101250104 | 0.06588458758446113 | 0.10418337068327634 | 0.09973791272254534 | 0.12411572223849726 | 0.13277927844800375 | 0.016966950020825194 | 0.26008454894287636 | 0.1491329123561601 | 0.11387160865280659 | 0.0726791735063124 | 0.13988066474128077 | 0.07967381472917236 | 0.09622715894375738 | 0.13682866071990807 | 0.10359973296287202 | 0.13363881793601778 | 0.09661522221901934 | 0.05473942674053222 | 0.0848423259869896 | 0.07076637320129568 | 0.013838374306534385 | 0.15605597881213873 | 0.19601007820682143 | 0.08836977939252832 | 0.025564563191582235 | 0.033220611558957724 | 0.21027216352892433 | 0.04486763086603088 | 0.20260002383125936 | 0.18225610387672683 | 0.0967037080854011 | 0.07007114387415894 | |||||||
| 131.082 | L-Ornithine [-H(+)] | cpd:C00077 | 0.09287143809956383 | 0.09697138858952857 | 0.24053123746988 | 0.6470367606475135 | 0.22013804642935716 | 0.227847330711892 | 0.14314734321288 | 0.030248261002388723 | 0.1616300074602513 | 0.10151919802642068 | 0.1261108743879435 | 0.07065778764153685 | 0.20783889913298778 | 0.16137544798701073 | 0.0804840240345319 | 0.018375900455352274 | 0.07030836392967772 | 0.06079878687175292 | 0.09232018552753128 | 0.11032410808750248 | 0.03730325039299218 | 0.130204163740992 | 0.06267447304271681 | 0.0409239627405996 | 0.08188568419483287 | 0.0284642144208049 | 0.09379043193771452 | 0.22100140944700084 | 0.12145953245130438 | 0.11252826472552228 | 0.1809748516495006 | 0.22494190794442984 | 0.11510976877968375 | 0.12482377643629945 | 0.17125380361013598 | 0.1625035174793316 | 0.11310630052130208 | 0.15752457868142908 | 0.3982668173096669 | 0.1978783791803159 | |||||||
| 132.03 | L-Aspartate [-H(+)] | cpd:C00049 | 0.04592706482006566 | 0.1363581354203249 | 0.30079010320391625 | 0.3008946688096573 | 0.31266642906232645 | 0.3048601646445816 | 0.2277481168304259 | 0.12430484272392694 | 0.24348811701251732 | 0.2459569004781367 | 0.17810250316759565 | 0.14435417029608608 | 0.3410699184941437 | 0.3469877172383209 | 0.0377740337787922 | 0.02680519996711245 | 0.0419415403943907 | 0.05343582447163853 | 0.2786562763411335 | 0.24405860700426105 | 0.05104971676306954 | 0.06268728096413233 | 0.08034390971870031 | 0.06810233727631486 | 0.04999469443509748 | 0.008415478538670083 | 0.13222719177555234 | 0.37356831946726404 | 0.14045775381976383 | 0.08309719931806706 | 0.05534063575238653 | 0.0508825883975729 | 0.13980148663169545 | 0.25942767560629365 | 0.5414910953039522 | 0.09070987535376952 | 0.09553356376489881 | 0.21498701972211945 | 0.11260640238805189 | 0.20171796354671326 | |||||||
| 134.029 | L-Homocysteine [-H(+)] | cpd:C00155 | 0.023663373508265126 | 0.26612497205414 | 0.895193715798898 | 0.38450672217136755 | 0 | 0 | 0 | 0.2601871520025653 | 0.34003037438145 | 0.34748532766678486 | 0.15839389742653684 | 0.2240459966414733 | 0.29676076286182823 | 0.1291680041429902 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 134.047 | Adenine [-H(+)] | cpd:C00147 | 0.11546476282129822 | 0.0258153986556066 | 0.23875564150583023 | 0.2019721480123511 | 0.043946371258692336 | 0.16309630268804312 | 0.04419999767013748 | 0.032224789010340295 | 0.06910095448150902 | 0.1934003573982784 | 0.1854693908154452 | 0.15160997323625797 | 0.15693775768827237 | 0.14106260416680239 | 0.07046618175704658 | 0.09502381319642858 | 0.05159319127733202 | 0.07016244649602191 | 0.2518923301034062 | 0.26314373712261135 | 0.06598279279179811 | 0.11633916113844116 | 0.042284403572379524 | 0.05539888547684093 | 0.02205065205337802 | 0.009997758752756146 | 0.05965084503048102 | 0.031901705979632954 | 0.08295826679292886 | 0.04783189981425748 | 0.06222314198049732 | 0.06894100377848518 | 0.3028508641568653 | 0.04885066794333983 | 0.042369822035522815 | 0.046850583357027534 | 0.15231584963938263 | 0.170665580369291 | 0.019656881226528845 | 0.01893441571242794 | |||||||
| 134.061 | L-Proline [+F(-)] | cpd:C00148 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1.88411095042053E-15 | 0 | 0.02600497001434208 | 0.08811422768883617 | 0.030863393760206352 | 0.11862874693621507 | 0.20465063971107517 | 0.32555052428132714 | 0.15620344219975313 | 0.07176117552470344 | 0.020460960559012545 | 0.0179575474479333 | 0.06676583435296025 | 0.06736651232393728 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 136.077 | L-Valine [+F(-)] | cpd:C00183 | 0 | 0 | 0 | 0 | 0.23636479329081891 | 0.1854088862183315 | 0.13734091673406054 | 0.3282783014328894 | 0.10898460042467585 | 0.5026218022068789 | 0.1253307837161774 | 0.21186485492152504 | 0.3704362503100217 | 0.23074884165659457 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.21538712117783063 | 0.08434675517281082 | 0.05594285879620338 | 0.3314443813791183 | 0.1322517121886483 | 0.3197706721106764 | 0.3566589381449379 | 0.13840826897397004 | 0.33944367447818824 | 0.20655820801572466 | 0.2427762015350329 | 0.3360454743298839 | 0.10000555998042841 | 0.2253550758214296 | |||||||
| 138.056 | L-Threonine [+F(-)] | cpd:C00188 | 0 | 0 | 0 | 0 | 0.14070940800101833 | 0.10813113848173038 | 0.26996216415009283 | 0.3474791272979185 | 0.12487572674381273 | 0.4482770136218086 | 0.07665314976748902 | 0.22304069631939974 | 0.2831585067776102 | 0.2219811113335236 | 0.12967234382419082 | 0.1308909488469745 | 0.14639225592603755 | 0.1078836006339903 | 0.24486505210163462 | 0.029123459500190362 | 0.02549040713542298 | 0.3622643607550489 | 0.12653497008058257 | 0.08703474495920921 | 0.1371201505725586 | 0.21684607457694655 | 0.20029679842937692 | 0.09196196755299323 | 0.11051182415580503 | 0.32479071958722755 | 0.08223263299893126 | 0.26898289089457444 | 0.40217655320741535 | 0.12954356678595072 | 0.2736955846840653 | 0.2553212843507844 | 0.20930724749359428 | 0.3417909230952108 | 0.0676642389626818 | 0.19780276696745763 | |||||||
| 138.98 | Acetyl phosphate [-H(+)] | cpd:C00227 | 0.3854309290364768 | 0.38111695684469277 | 0.19624898754991393 | 0.26489566241459944 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1.88411095042053E-15 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 139.975 | Carbamoyl phosphate [-H(+)] | cpd:C00169 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.10497482691956893 | 0.326968505164543 | 0.30655611168288255 | 0.2036564878894014 | 0.208776909811411 | 0.21000745305515064 | 0.4317931986748836 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.126197718606407 | 0.4318584608979069 | 0.26582477998912246 | 0.13871999829325268 | 0.3119872557546381 | 0.15288234442526866 | 0.21338483380603085 | 0.32549237790731056 | 0.3264260834783239 | 0.18966044878885577 | 0.22146107390106382 | 0.42734778124413 | 0.1541973665948878 | 0.16713298583957345 | |||||||
| 145.041 | Thymine [+F(-)] | cpd:C00178 | 0 | 0 | 0 | 0 | 0.1601430740219386 | 0.24908365851389747 | 0.28041493699803144 | 0.27982850766027034 | 0.07999977952517966 | 0.31609712753052555 | 0.09154532195008992 | 0.20852474237855978 | 0.17491057183037723 | 0.155651234062819 | 0.08651225417381748 | 0.1949827657666114 | 0.13028288172731337 | 0.15901509324082694 | 0.25120983414240705 | 0.11325822319940536 | 0.08088866198981244 | 0.18595270022239868 | 0.32006204326225685 | 0.17052668765560586 | 0.15507247698808657 | 0.16533499235680582 | 0.21085052390157502 | 0.07858741705585065 | 0.07432894145903945 | 0.39330880102282434 | 0.15331780935150882 | 0.24936215924232114 | 0.6545414299931084 | 0.06416914381144363 | 0.3010503935651993 | 0.2535546054293209 | 0.34689657599786117 | 0.30075566428011374 | 0.027455691111001643 | 0.21790549261625777 | |||||||
| 145.062 | L-Glutamine [-H(+)] | cpd:C00064 | 0.0698608641939046 | 0.11203862233875832 | 0.1612149648776448 | 0.3627332849237309 | 0.10810030865324703 | 0.08815715150979112 | 0.06387204794342753 | 0.2611203902192273 | 0.13536211589039773 | 0.1832236780250703 | 0.16385100291108431 | 0.31395000502027426 | 0.32822239685994514 | 0.21319572632033398 | 0.046303082800290475 | 0.1508320048714028 | 0.05098299246262289 | 0.19275862597922605 | 0.25684032783873323 | 0.1393105657131382 | 0.11599233087086788 | 0.12158065156713087 | 0.1821153774945568 | 0.18352366555634614 | 0.10548328635944214 | 0.08615097498185431 | 0.09002773935731283 | 0.05910976845860821 | 0.20435113557852516 | 0.14827681354901964 | 0.5030975708996495 | 0.3624719311561691 | 0.49413505190556845 | 0.1986460250862665 | 0.020926037220240477 | 0.05420197050619443 | 0.33386807191925405 | 0.26283396699466194 | 0.18351300052469002 | 0.2751996767750169 | |||||||
| 145.098 | L-Lysine [-H(+)] | cpd:C00047 | 0.13307519764076814 | 0.19572876292360616 | 0.27856676826837723 | 0.9615142798233913 | 0.18615171771519465 | 0.278472700743095 | 0.18958874125730402 | 0.0027824872992306985 | 0.4595190617013714 | 0.08779826796650395 | 0.051748570317619355 | 0.0936558133584683 | 0.3262506110727699 | 0.12576144792509175 | 0.05433177059701836 | 0.03294549946909877 | 0.04332500453111506 | 0.07699094106607336 | 0.02680385721858921 | 0.08429563356774969 | 0.0606958792584664 | 0.09061476311726502 | 0.005372048489599196 | 0.03516636228550045 | 0.048516224991011145 | 0.01848611059117486 | 0.13049544418799167 | 0.2622441642197627 | 0.1908079288302196 | 0.1679012393027448 | 0.20854693453555162 | 0.2563928068761512 | 0.21866050518551108 | 0.0764152721343126 | 0.1927079490924964 | 0.21699993544642313 | 0.10380250122489701 | 0.1812183194530865 | 0.38231029776961467 | 0.34156450159366925 | |||||||
| 146.046 | L-Glutamate [-H(+)] | cpd:C00025 | 0.03212356407800925 | 0.14927201841014334 | 0.22046588599010628 | 0.17010699346599048 | 0.17746695457840417 | 0.2683293953841428 | 0.17285296708840878 | 0.0873486526678885 | 0.12085585795134557 | 0.2437478096633635 | 0.22454676381315697 | 0.07672300455904682 | 0.2780440552478672 | 0.30113958715133005 | 0.017971268903219467 | 0.05904382753243795 | 0.09126817008336559 | 0.01564828096379297 | 0.19017636616061773 | 0.17941871366731704 | 0.08781707307537691 | 0.12646867610481308 | 0.050589152456289734 | 0.02344553562611615 | 0.017452092155138682 | 0.024549971770164214 | 0.13218907052729928 | 0.11170344651125409 | 0.04501756114048805 | 0.055837627856117025 | 0.10500841685075647 | 0.06322501233586632 | 0.09320527432097758 | 0.17179546798846976 | 0.35649596104915326 | 0.06974030134891633 | 0.33573643789971674 | 0.09702273012658227 | 0.030835964169355117 | 0.17785005393061942 | |||||||
| 148.043 | L-Methionine [-H(+)] | cpd:C00073 | 0.054727238639126985 | 0.05603132985203391 | 0.01914451222553134 | 0.18913798411972604 | 0.08532946849821982 | 0.110122580551571 | 0.0678608456915946 | 0.03556730785976816 | 0.04898440421559929 | 0.05962878242981715 | 0.11346919173916738 | 0.010760034101977924 | 0.04621067135264071 | 0.05810355050780212 | 0.05980387470398488 | 0.09764422720076996 | 0.032609014263276226 | 0.08730472469265622 | 0.06598716418914798 | 0.8843861256333158 | 0.03178003569479215 | 0.040808528388274 | 0.028444859471369016 | 0.0752564389561261 | 0.04678761876750569 | 0.03384745947449173 | 0.13852915910274877 | 0.11059507483006574 | 0.1263255771461872 | 0.17615679083560962 | 0.10352096260423603 | 0.1091427768793296 | 0.3341849030875857 | 0.20587455039366667 | 0.19207632044334222 | 0.08661718786421255 | 0.09540413612673733 | 0.09011565042353632 | 0.10381022360698293 | 0.15679560837432882 | |||||||
| 149.046 | D-Ribose [-H(+)] | cpd:C00121 | 0.06771806469979097 | 0.056484145663083934 | 0.13521685999842087 | 0.08706151964129961 | 0.19820675061660314 | 0.13568733090309465 | 0.19373909431789268 | 0.17341258108579033 | 0.5912928667913434 | 0.2987138412861453 | 0.24928099356518352 | 0.4182517671876113 | 0.5570488210396516 | 0.5385440935025055 | 0.1320445910255813 | 0.1605294147929384 | 0.1338478335274895 | 0.08570698801271101 | 0.18414832800201275 | 0.2239748791835799 | 0.1742677248760463 | 0.24557669484579908 | 0.07939006286881735 | 0.14281402146835528 | 0.04582951778975583 | 0.11775355677784725 | 0.604576935487548 | 0.4127444351041047 | 0.648453736200235 | 0.453627139661834 | 0.5689450967919674 | 0.08247929705816912 | 1.3730741173303884 | 0.5524324456077742 | 0.9586933544029633 | 0.5034534024428695 | 0.567653657687822 | 0.07159179919894162 | 0.07951848729736595 | 0.46838285293198567 | |||||||
| 150.042 | Guanine [-H(+)] | cpd:C00242 | 0.278038441349892 | 0.08357413686112465 | 0.22250014507498353 | 0.1739166030669083 | 0.14859617391216753 | 0.11179183109744802 | 0.17699128650888307 | 0.06172177266373172 | 0.07042397194205435 | 0.10572095882313123 | 0.03968978746622026 | 0.03739473663584861 | 0.15325579144351642 | 0.07023895500067807 | 0.11135928359766131 | 0.047027233251891065 | 0.09326688499374376 | 0.12126881534638399 | 0.05899525979927875 | 0.14481054276125863 | 0.09356126032647906 | 0.1539550802656334 | 0.1213307240197143 | 0.04601414711738459 | 0.068287853428205 | 0.1909932039817706 | 0.1310413632004315 | 0.09334338520642012 | 0.09708094535936969 | 0.07216838649846068 | 0.09624369884889059 | 0.08998413320197399 | 0.21749395745191388 | 0.06229526324604242 | 0.2950423627809841 | 0.08392755919591673 | 0.29617510017702886 | 0.16880377900948884 | 0.06316518089326337 | 0.1385118268543873 | |||||||
| 151.051 | L-Asparagine [+F(-)] | cpd:C00152 | 0 | 0 | 0 | 0 | 0.0936694865826308 | 0.13621236005945758 | 0.23722834651508043 | 0.2506386039835155 | 0.1367457337775236 | 0.4675398438179869 | 0.12321478516668892 | 0.27586573727910096 | 0.27170806542737574 | 0.22929787867281007 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.26944824678860635 | 0.02275851871441319 | 0.01790003417842456 | 0.2824958303685723 | 0.03820770904254609 | 0.17812081578986966 | 0.2878949393833471 | 0.05601988194429403 | 0.1000142650707324 | 0.22397334121077428 | 0.27216832012219316 | 0.20082779727825167 | 0.08980708563855624 | 0.21147731724280447 | |||||||
| 151.087 | L-Ornithine [+F(-)] | cpd:C00077 | 0 | 0 | 0 | 0 | 0.11965974012095372 | 0.17133525583418852 | 0.26287107949749783 | 0.14937403054588363 | 0.18935445136213147 | 0.5023354019078515 | 0.26732111460436647 | 0.44661746102977895 | 0.36629576531270863 | 0.19069488893638578 | 0.12628031832260891 | 0.21275840457017592 | 0.13909479321134027 | 0.1257662634075684 | 0.32068135914853807 | 0.44138112375971783 | 0.019505796417108173 | 0.2575795999796734 | 0.11736929582333633 | 0.3040095259233196 | 0.20059862688092486 | 0.08157568133835273 | 0.3488446023047662 | 0.2999638614207806 | 0.24031462926353933 | 0.2563659930945844 | 0.16511900569546847 | 0.22392894261712817 | 0.37414402300398014 | 0.23148219608313075 | 0.20983901756892004 | 0.16907072077069607 | 0.37556108384782516 | 0.18044326714188125 | 0.03500167396617803 | 0.15202927309609793 | |||||||
| 152.036 | L-Aspartate [+F(-)] | cpd:C00049 | 0 | 0 | 0 | 0 | 0.07348707739339219 | 0.16150233767002603 | 0.054705425206323495 | 0.14525667164387357 | 0.14714803254368797 | 0.4204870277080874 | 0.06697619220322958 | 0.1411216119037632 | 0.24906653558006658 | 0.12087350596271611 | 0.15236209545994286 | 0.0847835515988292 | 0.15390085339212384 | 0.23229662948275578 | 0.49223979942451146 | 0.31015240029266217 | 0.11737649957355732 | 0.045622997622357594 | 0.08226351073032866 | 0.019404483093296596 | 0.07582939306367828 | 0.032343848228625745 | 0.353734891616259 | 0.2738269320044128 | 0.3429083827245818 | 0.37204382976753714 | 0.2688114781889274 | 0.1323170447271215 | 0.8047607516738913 | 0.32191836561320414 | 0.47493807271226174 | 0.2863971540547906 | 0.23449342479479063 | 0.19309068966831183 | 0.031074032862835617 | 0.31426475833239886 | |||||||
| 154.033 | L-Homocysteine [+F(-)] | cpd:C00155 | 0 | 0 | 0 | 0 | 0.5125787898205811 | 0.43798785557149045 | 0.17107638592705113 | 0 | 0 | 0 | 0 | 0 | 9.42055475210265E-16 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.1801267507288754 | 0.1782419205042541 | 0.11952876229871938 | 0.33035330915472744 | 0.10755074893948631 | 0.05769810269606448 | 0.35102656263906573 | 0.1730807860343869 | 0.2511776100713219 | 0.16535648664851876 | 0.2911125312503863 | 0.1973947392017194 | 0.1209083909875928 | 0.03279623082729555 | |||||||
| 154.052 | Adenine [+F(-)] | cpd:C00147 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.1369135977343571 | 0.07181345724727826 | 0.08923151914921204 | 0.16185153508079372 | 0.04318304599446518 | 0.1411611255390142 | 0.14005476494671018 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.4569286358645622 | 0.4140947755875045 | 0.408788227061371 | 0.5178025114830026 | 0.3026707167238599 | 0.10963963424581567 | 1.2314419945018145 | 0.3412998074267489 | 0.4951885714155483 | 0.5229994747163 | 0.38049305086965485 | 0.12009750581112837 | 0.006663619659542378 | 0.33894746172244217 | |||||||
| 154.058 | L-Histidine [-H(+)] | cpd:C00135 | 0.13731345097102193 | 0.21624225088909088 | 0.25622001125022864 | 0.8374193733788575 | 0.07437978835466964 | 0.08745869098297201 | 0.09291058522618172 | 0.0026951390109929336 | 0.07874275450559022 | 0.27238938596229045 | 0.23947798824793878 | 0.07711840646740385 | 0.2365788959015172 | 0.16541429175441588 | 0.08370651536231441 | 0.06933206117576415 | 0.053721468353251034 | 0.07477097684533089 | 0.14127232583809823 | 0.12653301835194622 | 0.07201067678506382 | 0.0063276865493153865 | 0.03076830268561131 | 0.03698630762049343 | 0.019707151232443813 | 0.04299908907535833 | 0.0497482540121354 | 0.07326679799391987 | 0.03658724647508232 | 0.03344685898400487 | 0.12946679625865967 | 0.09077446748806876 | 0.03987382651073013 | 0.07581764541155234 | 0.10526920737443944 | 0.04756783994300882 | 0.34948403803838823 | 0.09224159311944602 | 0.05425169349172207 | 0.13567386354644184 | |||||||
| 159.977 | Carbamoyl phosphate [+F(-)] | cpd:C00169 | 0 | 0 | 0 | 0 | 0.2385771555861031 | 0.304030671455799 | 0.31100520464027936 | 1.150291348864762 | 1.0121068662795334 | 1.1306163987121147 | 0.4282695841917131 | 0.764749092262525 | 0.965997995704128 | 0.32961090987711633 | 0.19661344293549418 | 0.16625764692198136 | 0.045319339043043486 | 0.11174609615978034 | 0.10736411284559251 | 0.4526587999718639 | 0.12267418485655061 | 0.5503435529577227 | 0.4503901399275681 | 0.3813174451819428 | 0.17687314604025348 | 0.16936449059049297 | 0.16412164191779108 | 0.22288061518732105 | 0.38954623801541866 | 0.21800899263141463 | 0.07782747538776078 | 0.2951924799678784 | 0.3637199270115969 | 0.35102999890901043 | 0.5365266528530408 | 0.2965815284664447 | 0.6953210451637218 | 0.5733401019849818 | 0.2483985151703506 | 0.08497417171843266 | |||||||
| 164.072 | L-Phenylalanine [-H(+)] | cpd:C00079 | 0.08823890692129924 | 0.010689525748178108 | 0.16782802404156114 | 0.25390203196427624 | 0.06710278047371177 | 0.051406416776933875 | 0.049734813830205116 | 0.0657547393676011 | 0.1331389794938611 | 0.16494140430215015 | 0.10393321548230812 | 0.04686311004791588 | 0.1106869557692986 | 0.059754159079686446 | 0.02459402292082701 | 0.026324117887478748 | 0.03392728048172838 | 0.06781534880996437 | 0.0068417972228009254 | 0.05333181307887206 | 0.016994250652421293 | 0.03896143601385452 | 0.04449558325550522 | 0.027549290961867416 | 0.039594706862063955 | 0.002071421591696629 | 0.0746528136439611 | 0.12028177274114063 | 0.08006692591881907 | 0.08595403090322447 | 0.04593131747331383 | 0.07070771836235587 | 0.15146416823905842 | 0.0332902005822835 | 0.09369807663566276 | 0.1181431674474377 | 0.1665485786273929 | 0.10818966544154349 | 0.08175829621221571 | 0.10293886942247578 | |||||||
| 165.067 | L-Glutamine [+F(-)] | cpd:C00064 | 0 | 0 | 0 | 0 | 0.08276419581018908 | 0.15799241152329394 | 0.12814728985526305 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.22733877390139237 | 0.11331696365402755 | 0.11033779700318784 | 0.22283362585361746 | 0.1276902041865332 | 0.16581304725714682 | 0.22153446024878037 | 0.05449003309968472 | 0.1456838787301819 | 0.13093569154642112 | 0.7636424330663847 | 0.23995924743892694 | 0.10054348266347948 | 0.13122258826324662 | |||||||
| 165.104 | L-Lysine [+F(-)] | cpd:C00047 | 0 | 0 | 0 | 0 | 0.1584140402016821 | 0.17202044595486973 | 0.24546392120796345 | 0.14148379842354775 | 0.25139297739961375 | 0.5552339984929169 | 0.26867114573690815 | 0.4629864967797579 | 0.40398224877195377 | 0.2161719802886319 | 0.1029393735499975 | 0.1815838464981796 | 0.04772162466771439 | 0.20508076682818935 | 0.4300752702906841 | 0.4882545266089603 | 0.049126200748170645 | 0.23658048965150624 | 0.14409062256275482 | 0.2432870492329836 | 0.226447879356266 | 0.07897314094005833 | 0.3585989540849929 | 0.38313024444730803 | 0.31980225861848616 | 0.27219500508173006 | 0.23801166480679747 | 0.2806573509728506 | 0.38458199129593545 | 0.2693163904199433 | 0.17070672393937522 | 0.12729468611279446 | 0.36357934842553885 | 0.21499337378552083 | 0.14801786344759055 | 0.10646037557705892 | |||||||
| 166.052 | Pyridoxal [-H(+)] | cpd:C00250 | 0.19373183459683474 | 0.19036793483815695 | 0.060729158505103555 | 0.07205364646899941 | 0.07475388410312922 | 0.08994756072610512 | 0.18570424623196163 | 0.08893601124248438 | 0.12991350150332093 | 0.2217354267231311 | 0.12885340920069688 | 0.03825738812595297 | 0.24424722473116958 | 0.04552913164304228 | 0.33549427633950674 | 0.38053280830109093 | 0.17978135226756603 | 0.09757156022377009 | 0.15401200117434458 | 0.2658540167559798 | 0.051327566601752535 | 0.16417668367933952 | 0.13740537126154703 | 0.2362263432626392 | 0.07807856431991685 | 0.1194700131821575 | 0.35633741225424154 | 0.2078248366219449 | 0.38208403000918906 | 0.36923561846386754 | 0.20148276369399237 | 0.1538317593366317 | 0.7989558659628054 | 0.31818044500280324 | 0.4471844387124717 | 0.3197489182550788 | 0.32486848148304664 | 0.15557421527253507 | 0.0839021675092352 | 0.26251117583452455 | |||||||
| 168.054 | L-Methionine [+F(-)] | cpd:C00073 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.14073001397504004 | 0.12115319734490326 | 0.25304117962569334 | 0.1665514661650715 | 0.20461429701998898 | 0.19430061362072418 | 0.09763912541491152 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 168.991 | Glycerone phosphate [-H(+)] | cpd:C00111 | 0.34585649767281423 | 0.7122931260731681 | 0.8171807912719325 | 1.256944839039541 | 0.22783420322507422 | 0.40876865091946035 | 0.13343714379914012 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 169.05 | D-Ribose [+F(-)] | cpd:C00121 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.22669629439886357 | 0.0686326848721299 | 0.00605082908233133 | 0.46510008620604765 | 0.3107607374317733 | 0.39586699840620554 | 0.4144242834483782 | 0.09321480651277643 | 0.49904948346106115 | 0.3446346635008047 | 0.4617218741895915 | 0.6346427461370571 | 0.055384273528055694 | 0.27737436331733584 | |||||||
| 170.045 | Guanine [+F(-)] | cpd:C00242 | 0 | 0 | 0 | 0 | 0.29827473307090735 | 0.15808498625115108 | 0.22256151186245335 | 0.05163392259286801 | 0.19279024641723672 | 0.2198238173035303 | 0.08889932165136843 | 0.03319822252283136 | 0.11190430092694416 | 0.08144272765677216 | 0.17043428930048873 | 0.04641291528971969 | 0.049372346177408225 | 0.07033394152353342 | 0.09247646004271604 | 0.15247289975152511 | 0.06313246723601654 | 0.10570661961457146 | 0.30289957008523666 | 0.15013238819476196 | 0.0724205412033579 | 0.1048489993590877 | 0.13240538454057998 | 0.21179512500722028 | 0.044389845458861675 | 0.23736146673520975 | 0.044815510954986766 | 0.0702085299369008 | 0.24897830735282067 | 0.07045385873940477 | 0.20618090252738447 | 0.07133774081319592 | 0.2686373371377541 | 0.06897611229161604 | 0.16549131395581954 | 0.062238280628596133 | |||||||
| 171.007 | sn-Glycerol 3-phosphate [-H(+)] | cpd:C00093 | 0.13111081880355357 | 0.10920209381278702 | 0.10907552731738755 | 0.41448599101496575 | 0.5386037342876802 | 0.6414173682488565 | 1.127971187370103 | 0.09682255152335296 | 0.10841755333080812 | 0.3497928320020292 | 0.37231480780845366 | 0.0499399272381901 | 0.180143544709559 | 0.28263739278723526 | 0.23994432037492597 | 0.08954514309520224 | 0.3239041611703806 | 0.09355504072675594 | 0.4335622708038434 | 0.3167074078997864 | 0.13247558758805578 | 0.1547957422802496 | 0.17180358799932022 | 0.07464847073407753 | 0.22475290184693397 | 0.08083066697964983 | 0.07030858919190158 | 0.08941324570468755 | 0.12786711302209955 | 0.06526831129552145 | 0.0844359421384718 | 0.11587432156708388 | 0.42833069052167594 | 0.0454648575630025 | 0.14578916304177014 | 0.39933367793108476 | 0.18262953032316392 | 0.09844066262394646 | 0.011628804238450823 | 0.1545386639919809 | |||||||
| 173.105 | L-Arginine [-H(+)] | cpd:C00062 | 0.09799081324505264 | 0.16675610341859373 | 0.19128956532004487 | 0.7306555562360316 | 0.1708220681448235 | 0.26463641209868416 | 0.1527615984298134 | 0.0543908082704228 | 0.17420842527032573 | 0.09948906542600694 | 0.2068139954473302 | 0.06321963958344297 | 0.2706913707798244 | 0.14621892518944912 | 0.0559294433093933 | 0.04065275720407248 | 0.06456287573356931 | 0.0677693152040306 | 0.060683420071340165 | 0.07235040972646349 | 0.026275654653938437 | 0.12413070735247655 | 0.06291074493095432 | 0.033452714633301205 | 0.047840766989498504 | 0.029717343860790453 | 0.12073457991237672 | 0.2874325813290547 | 0.1571733246173206 | 0.1073056397534675 | 0.23555076457696145 | 0.2935790107167813 | 0.16865180183557135 | 0.12148198236768888 | 0.20163581971481911 | 0.19033320677072277 | 0.153831218883184 | 0.17789172077151236 | 0.46205460153038624 | 0.28078328104945055 | |||||||
| 174.067 | L-Histidine [+F(-)] | cpd:C00135 | 0 | 0 | 0 | 0 | 0.1301481916481245 | 0.1434499724684282 | 0.17045309634651062 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.200069133008463 | 0.16441701728254093 | 0.04984825109501054 | 0.2038613327071898 | 0.11712974381132404 | 0.18544438154149678 | 0.21125235623249838 | 0.11700555184035637 | 0.16608645044495812 | 0.15954234618175042 | 0.3413844168935451 | 0.30574017909067264 | 0.07022025783650702 | 0.18448767035890104 | |||||||
| 174.089 | L-Citrulline [-H(+)] | cpd:C00327 | 0.10939409072936958 | 0.3614699275963177 | 0.08996874027418578 | 0.6994766961233403 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1.88411095042053E-15 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.2293880130461362 | 0.03354342432194641 | 0.038845188793822594 | 0.14792861447200903 | 0.250901110767274 | 0.24558371911046237 | 0.18811284856819077 | 0.1148318942950628 | 0.04151103363995862 | 0.013161943393888712 | 0.10223057990379585 | 0.18344183241542633 | 0.07228506462357595 | 0.08885485039137228 | |||||||
| 175.026 | Ascorbate [-H(+)] | cpd:C00072 | 0 | 0 | 0 | 0 | 0.3516178375435127 | 0.13458051373236748 | 0.1431544360116458 | 0.06652165671566257 | 0.17047086253917107 | 0.3032975242363891 | 0.27139386094102935 | 0.131013099789997 | 0.24769662865664793 | 0.1260487784089906 | 0.07131536217078813 | 0.1407945604980541 | 0.21231417097851701 | 0.3558514922519149 | 0.24854307289324198 | 0.41236437082801847 | 0.16243952559441105 | 0.07104279142489954 | 0.18153820993448125 | 0.2223384526834455 | 0.11225944049136777 | 0.09057225969703066 | 0.3483482764086853 | 0.15609451010551212 | 0.15427114388594304 | 0.22156756486492218 | 0.4151004527491321 | 0.44735529664335705 | 0.4486608658876448 | 0.5093731674441485 | 1.038182947089843 | 0.3011820564165816 | 1.3541934687239223 | 0.9360201289844822 | 0.19513577582578653 | 0.19905587045863124 | |||||||
| 176.936 | Diphosphate [-H(+)] | cpd:C00013 | 0.29632451529039233 | 0.39179396513863335 | 0.4028352986531409 | 0.7322294002898909 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 179.056 | D-Glucose [-H(+)] | cpd:C00031 | 0.08327226301753349 | 0.15917508795563895 | 0.19633615143861863 | 0.5245370794063307 | 0.1022967258648439 | 0.13236912961327174 | 0.12465410101109349 | 0.13323658114757495 | 0.1938677392961357 | 0.154119599445766 | 0.1570856009018937 | 0.1341612889624867 | 0.30532699315509065 | 0.372737418226619 | 0.17991215134236666 | 0.029032401385783727 | 0.17763702710543197 | 0.05898885081161307 | 0.1702101360206934 | 0.10970166578382025 | 0.10016455556576688 | 0.180442495793233 | 0.04332367442280744 | 0.09535272830461432 | 0.039821288408100966 | 0.046353590865012784 | 0.19697149668364858 | 0.35250357742681904 | 0.1370249952648783 | 0.2843894874437139 | 0.12521632773763386 | 0.1900921470091982 | 0.5678873209390369 | 0.3891504176563905 | 0.8953245030951492 | 0.15275648304313458 | 0.15936877022763837 | 0.6891340924517997 | 0.11744739655931684 | 0.24820276442439193 | |||||||
| 180.067 | L-Tyrosine [-H(+)] | cpd:C00082 | 0.08146951266286469 | 0.0901814123400597 | 0.17984354971029948 | 0.30324957552363796 | 0.12456701566151132 | 0.11436545094669964 | 0.053786142781078565 | 0.07641570556647899 | 0.29700132697881176 | 0.28685120022442007 | 0.28769228159863397 | 0.0961096199695317 | 0.12414746723214015 | 0.01832055258465913 | 0.051548951327437614 | 0.009957762644043817 | 0.040780914567206415 | 0.08072322273213318 | 0.13588024015771605 | 0.1429697114464189 | 0.07652155557631624 | 0.05664946356177392 | 0.028806213056632786 | 0.021407900644770703 | 0.06916591756379346 | 0.023185193562866427 | 0.03531443305316215 | 0.1900874311537829 | 0.10321438980940605 | 0.0830432792429622 | 0.11436931221335558 | 0.09467327227610005 | 0.11331392211949169 | 0.06097414169252316 | 0.006650562747590506 | 0.12048201361750793 | 0.3231692913466362 | 0.06685759600722267 | 0.08487222634824002 | 0.039903745412303945 | |||||||
| 181.07 | Mannitol [-H(+)] | cpd:C00392 | 0.09063773648014055 | 0.1975295039663969 | 0.3019178312151215 | 0.20315641451819585 | 0.06922502675451257 | 0.11465296430489304 | 0.062565860101318 | 0.0259346421723809 | 0.2246139761667362 | 0.028579906405313084 | 0.08924503342803917 | 0.13747501141551788 | 0.0974805940381433 | 0.07389440963838628 | 0.028271437925866668 | 0.08707378042267991 | 0.029205703142541027 | 0.09942224954740705 | 0.18318834134115247 | 0.0196070684407216 | 0.034586493169207776 | 0.1843229723382103 | 0.059662057791751696 | 0.09440531144963218 | 0.06303430576229653 | 0.01849108973682938 | 0.05468536965573411 | 0.11615150738709605 | 0.06142660997202827 | 0.03738955934755134 | 0.0875262514328572 | 0.09474539194378175 | 0.058058466651703 | 0.06390495018182639 | 0.16938164090200622 | 0.025516070608796997 | 0.1104982324174417 | 0.1358486185837972 | 0.015100529300151131 | 0.03064764063287145 | |||||||
| 183.067 | Choline phosphate [-H(+)] | cpd:C00588 | 0.03968058001504562 | 0.22649240155759445 | 0.14474129335578015 | 0.06207239186232468 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 9.42055475210265E-16 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.25532700732313857 | 0.09425219220002819 | 0.0479047450335222 | 0.4977759804237679 | 0.22764498966896343 | 0.34571479045014947 | 0.36517062242291265 | 0.08163097970163424 | 0.4413647338269395 | 0.18831963751698147 | 0.5348966671629736 | 0.5299901200089504 | 0.0896777018739216 | 0.2134636848242272 | |||||||
| 184.073 | L-Phenylalanine [+F(-)] | cpd:C00079 | 0 | 0 | 0 | 0 | 0.15622722426270416 | 0.24085959290268388 | 0.27740336140698435 | 0.12139670033674756 | 0.44107115833615823 | 0.2514250322120188 | 0.3347372669765929 | 0.490825711219837 | 0.31745809885738424 | 0.19927524303133085 | 0.10590929972551831 | 0.08911273405610887 | 0.08498990388297081 | 0.1061459998639019 | 0.22383664779971585 | 0.2618744644300589 | 0.1339033880823752 | 0.008498230438616524 | 0.04247522625254008 | 0.029911511180156242 | 0.031441527466947984 | 0.11914091157435654 | 0.27524158750981037 | 0.2000026171188914 | 0.16585764359219504 | 0.12495045680028793 | 0.1937630701330854 | 0.08208861714904628 | 0.3526147172765832 | 0.18742863994814973 | 0.17661923319530745 | 0.07135774774099016 | 0.40666900812500173 | 0.21707107847251186 | 0.003621535964691086 | 0.16560715351919245 | |||||||
| 184.988 | 3-Phospho-D-glycerate [-H(+)] | cpd:C00197 | 0.6093929216808248 | 0.14222097277315154 | 0.49153237024762664 | 0.5472938113748709 | 0.3316327635717413 | 0.2242732513930829 | 0.21193263564784953 | 0.15199163563999524 | 0.4419870093962569 | 0.12437114729374835 | 0.15893119223911323 | 0.21965549112697835 | 0.30567358707531195 | 0.3614938874217033 | 0.1606255054165241 | 0.181269754717087 | 0.11266281703064362 | 0.21450017962857706 | 0.10261659865617259 | 0.04416764020515611 | 0.2723116403010503 | 0.5110852333535475 | 0.3460608692657531 | 0.29056733654786543 | 0.21907946885006868 | 0.22389029220050702 | 0.1567387271639637 | 0.07162203170124673 | 0.27310969328738505 | 0.384889667706411 | 0.14530229654129137 | 0.21696175605863458 | 0.2511281910972771 | 0.1912284854309976 | 0.5503811374523969 | 0.21670100128505684 | 0.21634219515494232 | 0.4501155257619363 | 0.15804632360127907 | 0.2413153149894749 | |||||||
| 186.058 | Pyridoxal [+F(-)] | cpd:C00250 | 0 | 0 | 0 | 0 | 0.13755426376649996 | 0.11600428066474627 | 0.1769917269300658 | 0.16111910469257185 | 0.07135732229021913 | 0.16791708753096118 | 0.12569104430087116 | 0.14334214087917407 | 0.1244178905884711 | 0.08558027702476348 | 0.15518660999109465 | 0.06353797178433053 | 0.04914863746446516 | 0.07847176446791906 | 0.08863225969250306 | 0.17439322051252515 | 0.028626002877519815 | 0.0789879718601445 | 0.054504403721440775 | 0.1892190534617198 | 0.10671090590709421 | 0.09310688400884012 | 0.2062593274024058 | 0.1293677640912305 | 0.0872213205722532 | 0.24854010431506598 | 0.16541668750917696 | 0.15000565993281248 | 0.12763682850213154 | 0.09267258548323987 | 0.17748224898298517 | 0.11002396462799413 | 0.2733000237141413 | 0.16669753944396515 | 0.051446066346530823 | 0.076606759015889 | |||||||
| 193.108 | L-Arginine [+F(-)] | cpd:C00062 | 0 | 0 | 0 | 0 | 0.1409923466246533 | 0.1092895798608398 | 0.18921151557803004 | 0.12401372566346876 | 0.09169061218672722 | 0.35347012124715466 | 0.09586991324009027 | 0.24573973079056619 | 0.15752625234017664 | 0.21849352842895772 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.20086478073917977 | 0.14103270874797555 | 0.6185046309235984 | 0.5173472503296016 | 0.17443463516921606 | 0.3789719738814765 | 0.38873286999783024 | 0.3558670769791121 | 0.7588284873533664 | 0.22821075984738337 | 1.6014278209258301 | 0.9110388919115678 | 0.08991927820929868 | 0.006490348225962635 | |||||||
| 194.094 | L-Citrulline [+F(-)] | cpd:C00327 | 0 | 0 | 0 | 0 | 0.15279486974307468 | 0.20729324130154647 | 0.2360448778019031 | 0.07490482613268601 | 0.3293264669239556 | 0.31852563737075795 | 0.25927296955911255 | 0.47275311308116486 | 0.3360467072726328 | 0.23360196453034843 | 0.1296597402673869 | 0.07160032509167231 | 0.07794102653358743 | 0.17136593841792505 | 0.3277498212018942 | 0.2677810322508511 | 0.08924660968552196 | 0.3342559190420827 | 0.03923633200561247 | 0.18095241453154065 | 0.02689863593383703 | 0.10733497621349887 | 0.2905396332657639 | 0.21201736568703122 | 0.18366697746891275 | 0.17084055507211857 | 0.19832961083375594 | 0.1845026951505779 | 0.309200123941224 | 0.1300054632237448 | 0.10792375700366608 | 0.1311290629052462 | 0.42483132698513904 | 0.13444590071030368 | 0.04682774563414835 | 0.09726454549620564 | |||||||
| 195.029 | Ascorbate [+F(-)] | cpd:C00072 | 0 | 0 | 0 | 0 | 0.13746331826386102 | 0.1199711003685957 | 0.1635789257795551 | 0.15222693266117487 | 0.2750524557820471 | 0.30372089530432234 | 0.0776930666208953 | 0.10777075131840215 | 0.2518904466443929 | 0.05356010260605693 | 0.18587275883585969 | 0.24282522489329683 | 0.22208833410596238 | 0.2514414608325682 | 0.27254439097286737 | 0.2181168740881081 | 0.0467990420144037 | 0.4853700614146485 | 0.2889743820634202 | 0.3435557069829282 | 0.18619219706107848 | 0.04381114828888692 | 0.18992713602492334 | 0.18297958727037422 | 0.17849713217694707 | 0.45599294290574877 | 0.07896742041628703 | 0.10016236569168395 | 0.5609245526113414 | 0.1967652336721295 | 0.7716506608219876 | 0.25990791033152155 | 0.6939955869835996 | 0.48924902441221557 | 0.10147037649818233 | 0.08155463071738568 | |||||||
| 199.002 | D-Erythrose 4-phosphate [-H(+)] | cpd:C00279 | 0.23221885681289303 | 0.5928897809508835 | 0.3084400143049945 | 1.4992094466025683 | 0.20041348679851448 | 0.2097383206746142 | 0.10074938711741946 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 199.062 | D-Glucose [+F(-)] | cpd:C00031 | 0 | 0 | 0 | 0 | 0.25566694663103784 | 0.08603783220744571 | 0.3152571282911139 | 0.5902184223427986 | 0.2676517499860331 | 0.3882265095461417 | 0.06897069320884076 | 0.2533679063871688 | 0.38282881676763075 | 0.18760332319588174 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.37446066477605955 | 0.40136783552391364 | 0.33461975220625045 | 0.8214727383423371 | 0.6318320277882683 | 0.7255808584202434 | 0.7587732573440251 | 0.2084320859762457 | 0.7082847647825207 | 0.4139841205874272 | 0.7916828198693645 | 1.0565915720153645 | 0.026443083532726747 | 0.6031916624185748 | |||||||
| 200.074 | L-Tyrosine [+F(-)] | cpd:C00082 | 0 | 0 | 0 | 0 | 0.09737972567357658 | 0.16974974556272815 | 0.16000528998897925 | 0.03166839672429614 | 0.20317453032713878 | 0.09978936937034226 | 0.15589781589669757 | 0.1949883671626044 | 0.1770763749127798 | 0.10006828318063507 | 0.12450794988098443 | 0.07690404697797089 | 0.08202363851142883 | 0.15616037850959388 | 0.11481427410440055 | 0.16273000618155878 | 0.05937315962152116 | 0.03921364054900237 | 0.04898543209434682 | 0.06170313539894897 | 0.029073037205118363 | 0.0998717219451952 | 0.13372607234564202 | 0.2519945825744604 | 0.07118143516005909 | 0.19578222907430523 | 0.16964574940117627 | 0.1703351482539489 | 0.18576567804597025 | 0.06622941896990185 | 0.17760591349166635 | 0.09799589834386835 | 0.6439121033250457 | 0.23364571765479944 | 0.011329516025071314 | 0.09040527270873706 | |||||||
| 201.078 | Mannitol [+F(-)] | cpd:C00392 | 0 | 0 | 0 | 0 | 0.13890449894375778 | 0.17367283560012137 | 0.24813341250639573 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.16032265281926597 | 0.07178258980164202 | 0.1708854326624069 | 0.1125881883355688 | 0.1927771386749333 | 0.22122014977038298 | 0.13634159425491285 | 0.2759703618047956 | 0.1701201672328011 | 0.271333975824128 | 0.20268085757563895 | 0.15137401427905425 | 0.2342713223211312 | 0.2667413761470686 | 0.12770629580853174 | 0.25678692144417437 | 0.10722296091649745 | 0.19694178891343134 | 0.2538517055996968 | 0.2524786654151186 | 0.23288157567344597 | 0.0261774838645996 | 0.7432417491508051 | 0.31646139768799014 | 0.17187994859152814 | 0.051365399050404936 | |||||||
| 203.068 | Choline phosphate [+F(-)] | cpd:C00588 | 0 | 0 | 0 | 0 | 0.1469221027255387 | 0.09244035577742889 | 0.10553551109458391 | 0.2898435632831457 | 0.14706332209729547 | 0.18257575932712614 | 0.2045197939439827 | 0.2564493317020593 | 0.2790091663433389 | 0.2425768216736341 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.03872608703662808 | 0.18390640029430097 | 0.17488454335054446 | 0.11680725330645263 | 0.3652637393681028 | 0.30409981480956394 | 0.5680203852561614 | 0.19286412430062605 | 0.08220615642463808 | 0.015343196469636264 | 0.09216895667073897 | 0.24776717505367407 | 0.08291160877998294 | 0.31955159486233503 | |||||||
| 203.082 | L-Tryptophan [-H(+)] | cpd:C00078 | 0.006997209718431667 | 0.14272258972438884 | 0.2868108631600784 | 0.33223659556141555 | 0.11079026370595878 | 0.12763851337253088 | 0.05592964071994435 | 0.1241649593328326 | 0.36265996005996515 | 0.2868063914467699 | 0.2719188235457652 | 0.10686643222664954 | 0.17888898281508878 | 0.07521719942050498 | 0.05162858151014959 | 0.060826679871311275 | 0.018717725331012323 | 0.1505448332419716 | 0.14624795139041807 | 0.04581776282918254 | 0.02128216607645541 | 0.04054453339950777 | 0.044750660361629696 | 0.07774489065289127 | 0.032167450193971894 | 0.021797127627190216 | 0.038266963785873825 | 0.20840281495572874 | 0.1188271342113198 | 0.0944565611155792 | 0.13546693766933982 | 0.0898124406562679 | 0.22193248492827974 | 0.057080187590754186 | 0.0816743307060866 | 0.12026470973120373 | 0.10051195662787885 | 0.07332490334029496 | 0.04819303665241004 | 0.017231598752994348 | |||||||
| 204.053 | Lipoamide [-H(+)] | cpd:C00248 | 0.11427606476500311 | 0.17062231158408397 | 0.2661037013064324 | 0.32924822246309204 | 0.11861125610762815 | 0.12951014358215326 | 0.1656998653875026 | 0.01771252934359601 | 0.11970446922493433 | 0.0839338418041537 | 0.11284695217700481 | 0.050043618731898755 | 0.14999718711929935 | 0.04101516819114821 | 0.03644891948468676 | 0.16478968216044534 | 0.18957686495936033 | 0.21628850890133317 | 0.17316023446953788 | 0.38075558947112087 | 0.14587012123810036 | 0.11768428541862533 | 0.0359473869611671 | 0.064588256288592 | 0.04950424161926009 | 0.016719143108087208 | 0.215704446565149 | 0.24586035239521176 | 0.07914297427580604 | 0.16713802342332243 | 0.12950284694263478 | 0.11976576995922474 | 0.12387090292889609 | 0.18098725814988195 | 0.35530606901840667 | 0.22703889364172203 | 0.7991102475475012 | 0.32935880606409074 | 0.039842830550594364 | 0.09404106515046053 | |||||||
| 206.068 | Dihydrolipoamide [-H(+)] | cpd:C00579 | 0.01780573601106771 | 0.2607714633055171 | 0.21477726329847271 | 0.6650371332333309 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.10298320027856984 | 0.28587342350214345 | 0.08697090168457884 | 0.044367388444555254 | 0.0569568878320971 | 0.06483740308401176 | 0.1822017633990796 | 0.12035947104986038 | 0.22616883121273093 | 0.03824250300875071 | 0.5402738858225786 | 0.14645038901507665 | 0.12102501774299945 | 0.051704859647427166 | |||||||
| 213.015 | 2-Deoxy-D-ribose 1-phosphate [-H(+)] | cpd:C00672 | 0.30411838016531656 | 0.06438223429368213 | 0.21831078678835356 | 0.19856554982566307 | 0.2294492810116136 | 0.09583533523830189 | 0.32504971797981885 | 0.17948590313967833 | 0.07054652065781117 | 0.08914473805896728 | 0.09505146566919027 | 0.2441332840513565 | 0.20149450216684173 | 0.09114762372547186 | 0.0457843979820471 | 0.08142087461856591 | 0.06997210601224735 | 0.03449252529601198 | 0.4347329616449149 | 0.23365950919727 | 0.09895276892573357 | 0.01999582153263189 | 0.2329730096126828 | 0.1086855612912077 | 0.11601471867693651 | 0.0658662119328514 | 0.14592797428401474 | 0.35179581601281446 | 0.1017513507434194 | 0.22795961529998232 | 0.03742644786778529 | 0.2926253905946686 | 0.36041008301052485 | 0.37911359052668997 | 0.4415913051628303 | 0.2144660097634427 | 0.1945680986822831 | 0.4421500802291476 | 0.27883026764236163 | 0.1399409048658951 | |||||||
| 223.086 | L-Tryptophan [+F(-)] | cpd:C00078 | 0 | 0 | 0 | 0 | 0.13687301038376296 | 0.17976319498625687 | 0.13307107229282528 | 0.21726691927441663 | 0.397843970187727 | 0.220490987556576 | 0.1254648639625892 | 0.3331422910948351 | 0.2519089456815341 | 0.20433621133887542 | 0.12893802773711657 | 0.10385565385730215 | 0.1789514562673333 | 0.205903846014251 | 0.10081317235691298 | 0.3235439122443868 | 0.05847482575878066 | 0.08969122053044301 | 0.043642638226571134 | 0.1411744578779716 | 0.12409811945512675 | 0.08595880623032373 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 224.057 | Lipoamide [+F(-)] | cpd:C00248 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.14229576485806603 | 0.18325392594871046 | 0.13938703628919674 | 0.13739671816530757 | 0.02766635874470319 | 0.16287262187166107 | 0.05620268156754053 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.41771798982845404 | 0.12352103729978163 | 0.17939891043237577 | 0.6463577386667456 | 0.12132296417681744 | 0.15549720502596107 | 1.2990266652052778 | 0.17494445441243417 | 0.5556632765509699 | 0.3713911276853157 | 0.42412750433167146 | 0.3753661161979296 | 0.1422335370942422 | 0.13882750711180514 | |||||||
| 226.071 | Dihydrolipoamide [+F(-)] | cpd:C00579 | 0 | 0 | 0 | 0 | 0.1300828528781691 | 0.12886695933567485 | 0.05232882246100821 | 0.14137702008658845 | 0.12788047387671783 | 0.1328978824605013 | 0.19519701372399487 | 0.13988017740689512 | 0.17643814949709602 | 0.08199054613842975 | 0.16218600839808192 | 0.19163079982880937 | 0.08483551773031667 | 0.470862351798681 | 0.08877057013781332 | 0.6281774235487123 | 0.1824119640583106 | 0.31325162242320537 | 0.06491184833600418 | 0.18600946568232257 | 0.11034534398270408 | 0.15441878356484628 | 0.21821866568481935 | 0.09488546198762098 | 0.05856280984928515 | 0.3715679761496853 | 0.1383178381135151 | 0.16209329989762708 | 0.4164391132006671 | 0.16166702787082948 | 0.32789692000934967 | 0.2028633932619143 | 0.44408359473724923 | 0.25492496446413204 | 0.006919933186210408 | 0.12222870379922653 | |||||||
| 226.084 | Deoxycytidine [-H(+)] | cpd:C00881 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.008968682243898195 | 0.22535771355341758 | 0.11322583077987239 | 0.21774121550106962 | 0.2517167496266393 | 0.13229201804254298 | 0.09310273021560192 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 227.067 | Deoxyuridine [-H(+)] | cpd:C00526 | 0.11906804925070696 | 0.11128074403573984 | 0.14643501242806536 | 0.20113606329412836 | 0 | 0 | 0 | 0.0783927900896114 | 0.05051951795110097 | 0.18783238355609172 | 0.11648532659669554 | 0.10940606157692045 | 0.16490229076031554 | 0.06217400758429255 | 0.09063709930773997 | 0.0676581289708294 | 0.12670996706530835 | 0.3026279188010971 | 0.10014931011675152 | 0.5000365096554683 | 0.042898081591063536 | 0.2005693119282068 | 0.07383831030325047 | 0.06371445406833437 | 0.07810133689336889 | 0.04695199508131881 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 229.012 | D-Ribose 5-phosphate [-H(+)] | cpd:C00117 | 0.137159225658684 | 0.09609322162350997 | 0.32352063703241135 | 0.07623617617671194 | 0.19059485197274373 | 0.24865096617391247 | 0.4822507925349945 | 0.0605815290686792 | 0.3189387189264058 | 0.16161716122637265 | 0.5231826359609208 | 0.08096390652865912 | 0.16774916951932287 | 0.08126953934144024 | 0.07951736227553116 | 0.08381998348884609 | 0.09651364144526912 | 0.22122698146650976 | 0.3096985716398093 | 0.30651492060809843 | 0.21613637912675235 | 0.5469772056457813 | 0.07286615548752765 | 0.12801403234417746 | 0.2702942000759907 | 0.1378113068358511 | 0.018611456337206057 | 0.10630321402110937 | 0.028189370154494353 | 0.23428556504237436 | 0.1363762741061196 | 0.03648879795108162 | 0.16293870779148648 | 0.047002860872552704 | 0.2716272894209152 | 0.10971098291802246 | 0.07978693907377496 | 0.16940796965274255 | 9.144002249450165E-4 | 0.22271168887646997 | |||||||
| 241.086 | Thymidine [-H(+)] | cpd:C00214 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.08585673897374009 | 0.22308150218413916 | 0.18234293839164095 | 0.3047876511242819 | 0.08567730373286633 | 0.18887855707146306 | 0.21545062080198868 | 0.2063826546104396 | 0.017303174192873996 | 0.11082300493318324 | 0.17331302052563943 | 0.3857194943478503 | 0.07036099462321527 | 0.1089141919322879 | 0.10438175823891525 | 0.191705880199833 | 0.045518652132616876 | 0.21521051158847668 | 0.11078436310840001 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 242.079 | Cytidine [-H(+)] | cpd:C00475 | 0.14849232330377618 | 0.09054803555036857 | 0.12444650216199996 | 0.030956744367795535 | 0.07687786742080013 | 0.0993996008755778 | 0.08391015579022805 | 0.015986016609875447 | 0.25553448742561263 | 0.1866169215129853 | 0.20898996539622752 | 0.07558453163663341 | 0.14891698589871474 | 0.1782218053256937 | 0.13228597916305976 | 0.040740389655243424 | 0.3693032405451156 | 0.13285524485533473 | 0.13948962510118537 | 0.03893229662581564 | 0.02921717407026278 | 0.29890817573231726 | 0.13556245134929054 | 0.15413653319130696 | 0.032876585791329335 | 0.22498195835875434 | 0.20213527684297475 | 0.09317342371996297 | 0.1433256749503694 | 0.10037338086046182 | 0.06787560479646822 | 0.03220243261127609 | 0.14910553851133593 | 0.1764171317732135 | 0.11343405864824158 | 0.01844521075354185 | 0.17965009396717888 | 0.07733935132912004 | 0.04854114276791668 | 0.05642159662699268 | |||||||
| 243.063 | Uridine [-H(+)] | cpd:C00299 | 0.13610818257345544 | 0.11998400429017125 | 0.16650078740487625 | 0.18416143888231334 | 0.11637638139294658 | 0.13572067043140645 | 0.12982820765107106 | 0.022097804596050635 | 0.2386933312913823 | 0.2079809837366223 | 0.1224030434422584 | 0.035108262620899305 | 0.14110078396684625 | 0.16962025226320893 | 0.1329843852798818 | 0.05268276699604497 | 0.11980733353940817 | 0.061385955489349504 | 0.20331703447106184 | 0.02718187735528169 | 0.01809635685981003 | 0.0714312450994672 | 0.07453991771277296 | 0.022891952814330707 | 0.045710177368904065 | 0.07921091148296704 | 0.06988489829289878 | 0.1309642931915483 | 0.05578474419850913 | 0.052346206750683716 | 0.06370701322613381 | 0.05696572832575791 | 0.2623781512402358 | 0.08328563563771849 | 0.11446591979943765 | 0.1018520610869813 | 0.15273369208190934 | 0.01157069417138998 | 0.001681466768969233 | 0.22367425867967156 | |||||||
| 246.015 | Pyridoxal phosphate [-H(+)] | cpd:C00018 | 0.07162903672227153 | 0.15949172608842443 | 0.025785494978332532 | 0.3343297667873344 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3432777222397579 | 0.3385879811288966 | 0.2904421905087343 | 0.24825159066150487 | 0.23953606870869698 | 0.13436829420202948 | 0.5361801069876614 | 0.2875845380688039 | 0.5442989761147026 | 0.2325361250487168 | 0.24760317688456135 | 0.07748254975994288 | 0.0648578209247971 | 0.26184351262884203 | |||||||
| 246.088 | Deoxycytidine [+F(-)] | cpd:C00881 | 0 | 0 | 0 | 0 | 0.10872299365755271 | 0.1931596930854237 | 0.15013769146206576 | 0.14710514859134843 | 0.11825819934973057 | 0.156028194740574 | 0.12238893642772859 | 0.15878362370940574 | 0.21038612872533322 | 0.08336282871207372 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.2290443451759961 | 0.20370780761443416 | 0.09692556400824606 | 0.20015373647763915 | 0.08466975773657179 | 0.029426977219225926 | 0.21390210036270524 | 0.07963024196010124 | 0.10830714900714918 | 0.02766327053467603 | 0.36942211232215594 | 0.18635517441955557 | 0.038857094248115565 | 0.06799902257605593 | |||||||
| 250.094 | Deoxyadenosine [-H(+)] | cpd:C00559 | 0 | 0 | 0 | 0 | 0.38901367212893856 | 0.23861229312968202 | 0.4883574846294442 | 0.21149538010268784 | 1.1065572218696873 | 0.3382203224190246 | 0.5172990591261986 | 0.9341004555077428 | 0.8104903250115131 | 0.9035596305656769 | 0.12028049190523424 | 0.031310256417171126 | 0.015166864141994888 | 0.2794522624003645 | 0.21066311418533232 | 0.18146174711264748 | 0.09098258361316083 | 0.06753018912417366 | 0.2541749990825452 | 0.018346361784847637 | 0.0805957166314717 | 0.2912840056060044 | 0.7025179531830679 | 1.4051068622722263 | 0.816608035123067 | 0.5184820865712856 | 0.6827594001805706 | 0.07943669508656583 | 1.8393149913373987 | 0.5985434841397197 | 0.9948539782778324 | 0.7560323280473884 | 0.16967913506534887 | 0.21024234747615847 | 0.2731024560174839 | 0.6418530192939665 | |||||||
| 257.104 | sn-Glycero-3-phosphocholine [-H(+)] | cpd:C00670 | 0.06965545247299855 | 0.1012335482247109 | 0.13993561738269095 | 0.45283961842534476 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 259.024 | D-Fructose 6-phosphate [-H(+)] | cpd:C00085 | 0.262667113789628 | 0.13807538397445226 | 0.2279366405614094 | 0.10738912149028662 | 0.7686087295711653 | 0.7462598247962056 | 0.24836997374053463 | 0.2877892872730671 | 0.0497753237514912 | 0.3094856403454753 | 0.2039343983894401 | 0.1752796018629746 | 0.3469460561415271 | 0.20654783317805747 | 0.06655667638953276 | 0.1268177151452886 | 0.12694637178369192 | 0.12263578244490958 | 0.3192784552110236 | 0.09416603518988238 | 0.12192507601333659 | 0.2280452934295017 | 0.14695601292818256 | 0.2621351744416431 | 0.040510577111196946 | 0.05928754184958003 | 0.06382160747110137 | 0.0888786698578566 | 0.1368622786560982 | 0.20236285478374783 | 0.17062099523899613 | 0.14952371191355815 | 0.24300487996443282 | 0.23611333191355338 | 0.6823065856676375 | 0.15037678431770776 | 0.12271495413963351 | 0.4398684096111525 | 0.06690187287014192 | 0.2485045821508931 |
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| # Fold change values including P-value, not corrected for batch effect which makes the data unsuitable for modelling purposes since the batch effect is relatively large compared to the biological changes in metabolite concentrations | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Unique ID | 24h_timecourse_4 | 24h_timecourse_4 | 48h_timecourse_4 | 48h_timecourse_4 | TF173_MPN303_5 | TF173_MPN303_5 | TF178_MPN250_5 | TF178_MPN250_5 | TF187_MPN674_5 | TF187_MPN674_5 | Tn051_MPN051_5 | Tn051_MPN051_5 | Tn674_N/A_5 | Tn674_N/A_5 | WT_WT_5 | WT_WT_5 | WT_WT_5 | WT_WT_5 | WT_WT_5 | WT_WT_5 | dldh,NoxE_N/A_5 | dldh,NoxE_N/A_5 | AA_perturbation_6 | AA_perturbation_6 | Fe_perturbation_6 | Fe_perturbation_6 | Glu_perturbation_6 | Glu_perturbation_6 | Gly_perturbation_6 | Gly_perturbation_6 | KO51_mutant_6 | KO51_mutant_6 | KO51_mutant_6 | Ox_perturbation_6 | Ox_perturbation_6 | TF173_mutant_6 | TF173_mutant_6 | TF183_mutant_6 | TF183_mutant_6 | TF414_mutant_6 | TF414_mutant_6 | TF462_mutant_6 | TF462_mutant_6 | TF463_mutant_6 | TF463_mutant_6 | Tn674_mutant_6 | Tn674_mutant_6 | blank_control_7 | blank_control_7 | WT_perturbation_7 | WT_perturbation_7 | WT_noGluc_perturbation_7 | WT_noGluc_perturbation_7 | TF173_mutant_7 | TF173_mutant_7 | TF178_mutant_7 | TF178_mutant_7 | TF184_mutant_7 | TF184_mutant_7 | TF187_mutant_7 | TF187_mutant_7 | TF413_mutant_7 | TF413_mutant_7 | TF462_mutant_7 | TF462_mutant_7 | TF463_mutant_7 | TF463_mutant_7 | Tn051_Gly_perturbation_7 | Tn051_Gly_perturbation_7 | Tn674_mutant_7 | Tn674_mutant_7 | WT_noGluc_perturbation_7 | WT_noGluc_perturbation_7 | water_Control_7 | water_Control_7 | |||||||||||||||
| Use in Model | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | |||||||||||||||
| Number | 30 | 30 | 31 | 31 | 35 | 35 | 37 | 37 | 41 | 41 | 49 | 49 | 52 | 52 | 54 | 54 | 55 | 55 | 56 | 56 | 57 | 57 | 58 | 58 | 60 | 60 | 62 | 62 | 63 | 63 | 64 | 64 | 65 | 66 | 66 | 72 | 72 | 74 | 74 | 80 | 80 | 81 | 81 | 82 | 82 | 90 | 90 | 97 | 97 | 98 | 98 | 99 | 99 | 104 | 104 | 106 | 106 | 107 | 107 | 108 | 108 | 111 | 111 | 113 | 113 | 114 | 114 | 120 | 120 | 124 | 124 | 126 | 126 | 127 | 127 | |||||||||||||||
| Protein KO (KO),overexpressed (TF), or perturbation | 24h | 24h | 48h | 48h | TF173 | TF173 | TF178 | TF178 | TF187 | TF187 | Tn051 | Tn051 | Tn674 | Tn674 | WT | WT | WT | WT | WT | WT | dldh,NoxE | dldh,NoxE | AA | AA | Fe | Fe | Glu | Glu | Gly | Gly | KO51 | KO51 | KO51 | Ox | Ox | TF173 | TF173 | TF183 | TF183 | TF414 | TF414 | TF462 | TF462 | TF463 | TF463 | Tn674 | Tn674 | blank | blank | WT | WT | WT_noGluc | WT_noGluc | TF173 | TF173 | TF178 | TF178 | TF184 | TF184 | TF187 | TF187 | TF413 | TF413 | TF462 | TF462 | TF463 | TF463 | Tn051 | Tn051 | Tn674 | Tn674 | WT_noGluc | WT_noGluc | water | water | |||||||||||||||
| Name of experiment to find the conditions | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| BATCH | 4 | 4 | 4 | 4 | 5 | 5 | 5 | 5 | 5 | 5 | 5 | 5 | 5 | 5 | 5 | 5 | 5 | 5 | 5 | 5 | 5 | 5 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | |||||||||||||||
| GLUCOSE in THE WASH | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 127 | ||||||||||||||
| Measurement type | timecourse | timecourse | timecourse | timecourse | MPN303 | MPN303 | MPN250 | MPN250 | MPN674 | MPN674 | MPN051 | MPN051 | N/A | N/A | WT | WT | WT | WT | WT | WT | N/A | N/A | perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | mutant | mutant | mutant | perturbation | perturbation | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | control | control | perturbation | perturbation | perturbation | perturbation | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | perturbation | perturbation | mutant | mutant | perturbation | perturbation | Control | Control | |||||||||||||||
| REFERENCE | 6h | 6h | 6h | 6h | MEDIAN block 5 | REF2 block 5 | MEDIAN block 5 | MEDIAN block 5 | REF2 block 5 | MEDIAN block 5 | MEDIAN block 5 | MEDIAN block 5 | TnGnt,TnPuro | WT | WT | WT | WT | WT | WT | WT | WT | REF Carolina block 6 | Gent-Cm | WT | WT | REF2 block 6 | REF2 block 6 | REF2 block 6 | REF2 block 6 | REF2 block 6 | REF Tns block 6 | REF block 7 | WT | WT_noGluc | REF block 7 | REF block 7 | REF block 7 | REF block 7 | REF block 7 | REF block 7 | REF block 7 | Tn051 | REF block 7 | WT | WT | |||||||||||||||||||||||||||||||||||||||||||||
| MPN | MPN303 | MPN303 | MPN250 | MPN674 | MPN051-KO | MPN674-KO | MPN674-KO, NoxE OE | KOMPN51-gpsA | KOMPN51-gpsA | KOMPN51-gpsA | MPN303 | MPN606 | MPN430 | MPN025 | MPN302 | MPN674-KO | MPN303 | MPN250 | MPN627 | MPN674 | MPN051 | MPN025 | MPN302 | MPN05-KO1 | MPN674-KO | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Pathway | Glycolysis | Glycolysis | Pyruvate metabolism | Glycerophospholipid metabolism | Glycolysis | Glycolysis | Glycolysis | NA | Glycolysis | Glycolysis | Glycolysis | Glycolysis | Glycolysis | Phosphotransferase system (PTS) | Glycolysis | Glycerophospholipid metabolism | Glycolysis | Glycolysis | Glycerophospholipid metabolism | Glycolysis | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Gene name | pyk | pgi | ldh | glpD | ldh | pyk | eno | gap | tsr | pfkA | ldh | pyk | pgi | ptsI | ldh | glpD | tsr | pfkA | glpD | ldh | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| mRNA fold | 1.291214505 | 1.4085032795 | 1.26939831 | NA | NA | NA | NA | 1.291214505 | 0.549999999999999 | 0.27 | 0.48 | 3.4236509485 | NA | 1.291214505 | 1.4085032795 | 1.7384333675 | 1.26939831 | 4.03464644 | 0.48 | 3.4236509485 | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Protein fold | ND | 0.805 | 0.4 | NA | NA | NA | NA | ND | 0.41499999999999904 | ND | ND | ND | NA | ND | 0.805 | 1.425 | 0.4 | ND | ND | ND | NA | NA | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Protein (estimation) | 1.2639698789445 | 1.2639698789445 | 0.264303 | 0.46987199999999996 | 3.35141191348665 | 1.2639698789445 | 3.949515400116 | 0.46987199999999996 | 3.35141191348665 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| m/z | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | |
| 59.015 | Acetate [-H(+)] | cpd:C00033 | -0.08772803 | 0.14255712 | -0.59897756 | 0.00222918 | 0.43382152 | 0.14406934 | 0.56329858 | 0.66661983 | 0.237486 | 0.25423779 | 0.23581002 | 0.41640352 | 0.73675355 | 0.29683334 | 0.74543391 | 0.02234644 | 0.21225551 | 0.3224821 | 0.72676469 | 0.07112492 | 0.06068363 | 0.00223 | -0.41962544 | 0.04527333 | -0.43558198 | 0.03025433 | -0.88249942 | 0.0012937 | -0.13708371 | 0.20117158 | -0.34694046 | 0.12292091 | 0.49662622 | -0.16196736 | 0.52948101 | 0.6207101 | 0.0758533 | 0.62348882 | -0.2554397 | 0.61972678 | -0.15142072 | 0.44889669 | -0.23555429 | 0.0366982 | -0.47618216 | 0.00178908 | 0.25596178 | 0.27380751 | -1.61303227 | 0.0036186 | -0.52325429 | 0.2687978 | -0.10159866 | 0.35985527 | -0.02119126 | 0.92431988 | 0.07390864 | 0.0741626 | 0.32968947 | 0.01842743 | -0.38100331 | 0.73947692 | -0.09967462 | 0.78853958 | 0.81784305 | -0.31269645 | 0.26927839 | 0.01499603 | 0.19027661 | -1.17699878 | 1.2965E-4 | -0.25240545 | 0.04456477 | |||||||||||||||
| 492.163 | 10-Formyltetrahydrofolate [+F(-)] | cpd:C00234 | Folinic acid [+F(-)] | cpd:C03479 | 0.00606641 | 0.64980665 | -0.3360511 | 0.07206483 | -0.05326385 | 0.67864932 | -0.41088063 | 0.02515179 | 0.09998887 | 0.89832401 | 0.41702269 | 0.33821557 | 0.29006328 | 0.04314 | -0.45103253 | 0.45835574 | 0.34798334 | 0.12866657 | -0.06363267 | 0.3169569 | -0.5939961 | 0.02151461 | -0.2673682 | 0.42024581 | -0.48258299 | 0.00554315 | -1.15417127 | 1.0903E-4 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 472.154 | 10-Formyltetrahydrofolate [-H(+)] | cpd:C00234 | Folinic acid [-H(+)] | cpd:C03479 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 213.015 | 2-Deoxy-D-ribose 1-phosphate [-H(+)] | cpd:C00672 | 2-Deoxy-D-ribose 5-phosphate [-H(+)] | cpd:C00673 | -0.00804265 | 0.08919446 | 0.35547098 | 0.00463453 | 0.08157182 | 0.66502946 | -0.02913349 | 0.70660138 | 0.10296159 | 0.2206738 | 0.53702621 | 7.0092E-4 | -0.03619493 | 0.84959752 | 0.28332568 | 0.11553859 | -0.19826883 | 0.3065357 | -0.09390077 | 0.11585315 | -0.36257936 | 0.00463454 | -0.27897715 | 0.00400562 | -0.06271131 | 0.61071735 | 0.29275908 | 0.00824002 | -0.02745213 | 0.67059562 | 0.06494338 | 0.31497542 | 0.45626211 | -0.01080623 | 0.69869915 | 0.08348127 | 0.18999865 | -0.05543381 | 0.06554487 | -0.1524141 | 0.22664421 | 0.1778617 | 0.17653083 | 0.08427839 | 0.62568268 | -0.03745273 | 0.90815414 | -0.46051444 | 0.00799821 | -0.31167242 | 0.1532412 | -0.23629996 | 0.38662203 | -0.09324667 | 0.2102995 | -0.03721707 | 0.4075019 | -0.02048918 | 0.59693225 | -0.10866144 | 0.81084955 | -0.11274815 | 0.69340057 | 0.1401994 | 0.90764148 | 0.09060774 | 0.60435784 | -0.18345258 | 0.24496108 | -0.11349378 | 0.95170519 | -0.25718067 | 0.16502347 | 0.16889153 | 0.02890723 | |||||||||||
| 273.005 | 3-Dehydro-L-gulonate 6-phosphate [-H(+)] | cpd:C14899 | -0.03466077 | 0.88782828 | 0.08819286 | 0.96189856 | 0.51766997 | 0.3054867 | 0.00736263 | 0.47252253 | 0.17668089 | 0.44049266 | 0.18671896 | 0.05507073 | -0.12427107 | 0.71938596 | 0.05024686 | 0.13483175 | -0.04959586 | -0.3144427 | 0.38453632 | -0.09426554 | 0.1964941 | 0.04978696 | 0.73507904 | -0.3261869 | 0.00609695 | -0.13294872 | 0.5593425 | 0.11300727 | 0.14565454 | 0.0483941 | 0.24499854 | -0.10751494 | 0.19942551 | 0.10387924 | 0.81069493 | 0.05583841 | 0.71258937 | -0.3779526 | 0.05305537 | 0.08170352 | 0.2992982 | -0.29196078 | 2.9792E-4 | 0.44073412 | 0.00462408 | |||||||||||||||||||||||||||||||||||||||||||
| 184.988 | 3-Phospho-D-glycerate [-H(+)] | cpd:C00197 | 2-Phospho-D-glycerate [-H(+)] | cpd:C00631 | 0.63978493 | 0.00506133 | 0.42738388 | 0.01006609 | -0.17729141 | 0.34700958 | 0.52636616 | 0.3935115 | 0.09163495 | 0.13525588 | -0.43297872 | 0.02021687 | 0.24291502 | 0.53279774 | 0.33847229 | 0.01679377 | -0.26132595 | 0.16438401 | 4.5519E-4 | 0.90711404 | -1.11188942 | 0.0101 | 0.82031881 | 9.7198E-4 | 0.02985791 | 0.88802745 | 0.06101937 | 0.35725835 | -0.73042964 | 0.00957048 | -0.42098089 | 0.00342226 | 0.0031279 | -0.64063839 | 7.5715E-4 | -0.0470525 | 0.92898944 | 0.49513185 | 0.12974594 | -0.09024961 | 0.87286771 | -0.27498081 | 0.32069461 | -0.24551619 | 0.1929436 | -0.2313274 | 0.31828648 | -0.14928934 | 0.4578368 | -0.6451985 | 0.04718425 | 0.11814957 | 0.46494802 | -0.20281063 | 0.2552943 | 0.07387765 | 0.74805823 | 0.18742752 | 0.10830089 | 0.20456731 | 0.0794484 | -0.1661778 | 0.83255983 | 0.02306016 | 0.91583034 | 0.09878254 | 0.50761689 | 0.13395089 | 0.65326655 | -0.22610374 | 0.17797278 | -0.7569237 | 0.0022414 | 0.77177644 | 0.00261731 | |||||||||||
| 284.96 | 3-Phospho-D-glyceroyl phosphate [+F(-)] | cpd:C00236 | -0.04340336 | 0.92951543 | 0.17274754 | 0.8949165 | 0.147635 | 0.14848519 | -0.00656714 | 0.54540066 | 0.19843957 | 0.33596728 | 0.10279704 | 0.31189538 | 0.03070275 | 0.64852367 | -0.0744362 | 0.87215071 | -0.00637583 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 264.95 | 3-Phospho-D-glyceroyl phosphate [-H(+)] | cpd:C00236 | -0.13107291 | 0.73344214 | -0.39754499 | 0.03794414 | 0.03794414 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 475.163 | 5,10-Methenyltetrahydrofolate [+F(-)] | cpd:C00445 | 0.64694895 | 0.93107265 | -0.22800248 | 0.0595324 | 0.0595324 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 455.159 | 5,10-Methenyltetrahydrofolate [-H(+)] | cpd:C00445 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 476.167 | 5,10-Methylenetetrahydrofolate [+F(-)] | cpd:C00143 | 0.5281868 | 0.94220619 | -0.31652084 | 0.04768196 | -0.09661243 | 0.0688839 | -0.0776767 | 0.75543416 | 0.02845556 | 0.73497829 | -0.10586689 | 0.00842343 | 0.0705616 | 0.55151101 | -0.33683897 | 0.73459559 | -0.13238817 | 0.94496155 | 0.10447375 | 0.0059204 | 0.0907466 | 0.04768196 | 0.15960229 | 0.21269975 | 0.45349875 | 0.10445141 | -0.41734517 | 0.19625386 | -0.19783261 | 0.75008027 | -0.09970858 | 0.60490974 | 0.82908489 | -1.73839784 | 0.00102729 | 0.12301442 | 8.441E-5 | -0.09639581 | 0.00262468 | -0.14744116 | 0.14887497 | -0.06565114 | 0.01428798 | 0.10417396 | 0.23639307 | -0.06065111 | 0.95074306 | |||||||||||||||||||||||||||||||||||||||||
| 408.947 | 5-Phospho-alpha-D-ribose 1-diphosphate [+F(-)] | cpd:C00119 | 0.36740572 | 0.05030136 | 0.6140934 | 0.0229023 | 0.0229023 | 0.18337247 | 0.0133722 | -0.56333255 | 0.05146246 | -0.12959168 | 0.71135361 | -0.09474935 | 0.16377637 | -0.01922826 | 0.53750234 | 0.37997671 | 0.01112377 | 0.34798502 | 0.00360444 | 0.12066545 | 0.84378387 | -0.08431992 | 0.32699956 | -0.04714348 | 0.73337339 | 0.10901644 | 0.19642135 | 0.28564545 | 0.01492919 | -0.5007061 | 0.00278085 | 0.97650393 | 0.03187723 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 388.945 | 5-Phospho-alpha-D-ribose 1-diphosphate [-H(+)] | cpd:C00119 | 0.32934635 | 0.0974587 | 0.18309197 | 0.36988021 | -0.00400336 | 0.80814611 | 0.50852134 | 0.79949609 | -0.03671582 | 0.92980607 | 0.20932988 | 0.11064333 | -0.14751102 | 0.67225373 | 0.66813596 | 0.00448554 | -0.08505006 | 0.57968562 | 0.25832578 | 0.09409965 | -0.69828545 | 0.37 | -0.98846619 | 6.8845E-4 | -0.12363035 | 0.17651217 | -0.30213028 | 0.37785318 | 0.67166149 | -0.12291789 | 0.13964457 | -0.31240642 | 0.32594736 | -0.1212298 | 0.81149504 | 0.45017732 | 0.00477433 | -0.25047171 | 0.49004039 | -0.36295082 | 0.58668713 | -0.51701913 | 0.13723054 | -0.62698825 | 0.26933632 | -0.19450717 | 0.67280926 | -0.05935607 | 0.82984177 | |||||||||||||||||||||||||||||||||||||||
| 138.98 | Acetyl phosphate [-H(+)] | cpd:C00227 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 808.118 | Acetyl-CoA [-H(+)] | cpd:C00024 | 0.27335447 | 0.23338127 | 1.43267267 | 0.61528112 | -0.15491949 | 0.67487258 | 0.32095366 | 0.20123325 | -0.18857621 | 0.75920526 | 1.0875976 | 0.02550934 | 0.35179869 | 0.84734962 | -0.17318313 | 0.88138935 | -1.99806951 | -0.6507156 | 0.00148913 | 0.28610672 | 0.24559229 | 0.40090393 | 0.1790812 | -0.08337486 | 0.48544258 | -0.21780381 | 0.00223582 | -0.23104131 | 0.00187403 | 0.06745301 | 0.91285423 | 0.28093675 | 0.00832421 | -0.1599907 | 0.39246123 | 0.25427828 | 0.30728671 | -0.02087993 | 0.63608504 | -0.33064321 | 0.512 | -0.24708668 | 0.35191118 | -0.62484644 | 0.15326353 | |||||||||||||||||||||||||||||||||||||||||||
| 154.052 | Adenine [+F(-)] | cpd:C00147 | -0.08309609 | 0.27595956 | 0.07357329 | 0.32805863 | 0.07809487 | 0.59458684 | 0.12102381 | 0.91694771 | 0.02529606 | 0.75095258 | 0.40051117 | 0.00505066 | 0.09313152 | 0.16219866 | 0.083942 | 0.22546906 | -0.01611884 | -0.00213821 | 0.89454329 | -1.75034706 | 9.421E-5 | -0.8373422 | 0.00631112 | -0.45375639 | 0.0377346 | 0.17893109 | 0.89546774 | 0.32191466 | 0.37749663 | 0.487122 | 0.01743346 | -0.84038406 | 0.40051752 | 0.27569148 | 0.2254846 | -0.36917748 | 0.16302271 | -0.39790077 | 0.21431625 | -0.49353754 | 0.2210397 | -1.06165789 | 0.00165389 | -0.01128125 | 0.50086573 | |||||||||||||||||||||||||||||||||||||||||||
| 134.047 | Adenine [-H(+)] | cpd:C00147 | 0.09667844 | 0.00581869 | 0.2428404 | 0.00540025 | 0.0149503 | 0.3616046 | -0.03472282 | 0.25535078 | 0.06357375 | 0.95490146 | -0.17037584 | 0.07636334 | -0.10765381 | 0.65665933 | 0.2348374 | 0.00142387 | -0.03013049 | 0.56816539 | -0.08353705 | 0.38599308 | -0.11476699 | 0.0054 | 1.66773607 | 2.426E-5 | 1.72436463 | 3.096E-5 | 1.82315788 | 1.197E-5 | 1.35528547 | 5.389E-5 | -0.17735819 | 0.11251197 | 0.11631406 | 1.518879 | 9.5113E-4 | 0.04854646 | 0.93610649 | 0.05484839 | 0.59991651 | -0.02397598 | 0.11034463 | 0.51451585 | -0.00860511 | 0.42410677 | 0.06079844 | 0.01743868 | -0.2953345 | 5.3097E-4 | 0.45274449 | 0.06615558 | 0.31541412 | 0.14404966 | 0.07102588 | 0.37531843 | -0.02229037 | 0.76791611 | -0.1049447 | 0.12250322 | -0.11034291 | 0.02204299 | 0.18070756 | 0.37219594 | -0.06762864 | 0.0340999 | 0.03466536 | 0.12980697 | -0.05652671 | 0.07464525 | -0.23730124 | 0.11775909 | 0.11751626 | 0.00660919 | 0.05502249 | 0.0459464 | ||||||||||||||
| 286.094 | Adenosine [+F(-)] | cpd:C00212 | Deoxyguanosine [+F(-)] | cpd:C00330 | -0.18736032 | 0.25919214 | -0.34454489 | 0.02871835 | -0.2645779 | 4.1247E-4 | -0.22534373 | 0.64992314 | -0.0280117 | 0.23751956 | -0.22398276 | 0.40593273 | -0.12227757 | 0.61124121 | 0.0443629 | 0.18672008 | -0.08447823 | 0.27378809 | 0.06137745 | 0.04798792 | 0.12199418 | 0.02871835 | 1.42355998 | 3.9280000000000003E-5 | 1.67578451 | 1.235E-5 | 0.09150274 | 0.28453351 | 1.38462278 | 5.336E-5 | -0.34946676 | 0.1068149 | 0.1210199 | -0.03239793 | 0.60793188 | -0.09372308 | 0.5329429 | -0.12963621 | 0.0132248 | -0.03011196 | 0.74197451 | -0.09687279 | 0.32971881 | 0.15595962 | 0.40025187 | -0.19943457 | 0.04924878 | 0.06374047 | 0.10331741 | 0.11851921 | 0.66961153 | 0.23216228 | 0.01881685 | 0.04066107 | 0.25353057 | -0.07299128 | 0.89352353 | -0.10463895 | 0.56170146 | 0.08035644 | 0.17759329 | 0.27910709 | 0.42310798 | -0.06760414 | 0.56659386 | -0.14516552 | 0.85388157 | -0.84078719 | 0.01297776 | 0.01046662 | 0.49070807 | -0.25207265 | 0.00386391 | -0.41327204 | 0.01644708 | |||||||||||
| 266.089 | Adenosine [-H(+)] | cpd:C00212 | Deoxyguanosine [-H(+)] | cpd:C00330 | -0.10555758 | 0.8993476 | -0.04391966 | 0.7710409 | 0.10973038 | 0.58692456 | 0.02867212 | 0.32527959 | 0.12941489 | 0.58338462 | -0.21608464 | 0.50327771 | 0.01224731 | 0.54366596 | 0.57273006 | 0.04042022 | 0.20123096 | 0.06751578 | 0.07905441 | 0.26912415 | -0.0793016 | 0.7710409 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 426.022 | ADP [-H(+)] | cpd:C00008 | Adenosine 3',5'-bisphosphate [-H(+)] | cpd:C00054 | dGDP [-H(+)] | cpd:C00361 | 0.73500032 | 0.03967612 | 1.53352849 | 1.668E-5 | 0.59161683 | 0.04089052 | 0.74549008 | 0.61931927 | 0.03544897 | 0.54503543 | -0.19213511 | 0.26387765 | -0.22334311 | 0.67239652 | 1.26195481 | 0.0017177 | 0.33591765 | 0.242226 | 0.66703472 | 0.23272099 | -0.80140814 | 1.67E-5 | -1.04193608 | 0.01212985 | -1.41690471 | 0.00406351 | 0.47229813 | 0.0375977 | -1.08406797 | 0.00142294 | -0.62994806 | 0.07090882 | 0.32886408 | -3.87332324 | 6.6E-7 | -2.6869E-4 | 0.84532467 | 0.31334679 | 0.19894846 | 0.17508303 | 0.95957482 | -0.6650666 | 0.05709002 | -0.13508699 | 0.48430644 | 0.58351 | 0.02133439 | -2.92975159 | 9.001E-5 | 0.58347242 | 0.24371366 | 0.18427379 | 0.53050949 | -0.00757718 | 0.6747912 | -0.13978519 | 0.64896101 | -0.22192101 | 0.35372517 | 0.13814346 | 0.70809947 | 0.40617042 | 0.10325648 | -0.07035959 | 0.61821472 | 0.27579455 | 0.90104756 | 0.05283979 | 0.86266098 | -0.5489862 | 0.00800737 | 0.14730053 | 0.8391364 | -0.92082878 | 0.00217541 | |||||||||
| 346.057 | AMP [-H(+)] | cpd:C00020 | dGMP [-H(+)] | cpd:C00362 | 0.59207604 | 0.00754076 | 0.92878194 | 0.00142195 | -0.27287282 | 0.32693254 | -0.10126005 | 0.51054701 | -0.45007015 | 0.05016972 | 0.09987918 | 0.83569385 | -0.40177767 | 0.08034626 | 0.1836974 | 0.08856493 | 0.30421681 | 0.26666625 | -0.07081952 | 0.39563566 | -0.63553155 | 0.00142 | 0.1816274 | 0.12326658 | -0.20038454 | 0.47961243 | 1.04647224 | 0.00256415 | -0.36311016 | 0.12565681 | -0.13814942 | 0.46495441 | 0.54876813 | -0.52098364 | 0.01987486 | 0.43031599 | 0.02476283 | 0.26926079 | 0.43705604 | 0.22769333 | 0.34078095 | -0.08876503 | 0.23841732 | 0.02112347 | 0.32733915 | 0.28014732 | 0.00222385 | -0.76298764 | 3.6445E-4 | 0.34546778 | 0.21842627 | 0.34143838 | 0.12967449 | -0.0347106 | 0.40097835 | -0.11294863 | 0.85790112 | -0.0774091 | 0.98441544 | 0.27201873 | 0.02787769 | 0.12737372 | 0.28651064 | 0.08915777 | 0.69092625 | -0.05432412 | 0.73757988 | 0.39959531 | 0.43056341 | -0.19521304 | 0.0645238 | -0.00258727 | 0.80494761 | -0.80563476 | 0.00520596 | |||||||||||
| 195.029 | Ascorbate [+F(-)] | cpd:C00072 | 0.04119495 | 0.52706051 | 0.00363916 | 0.74343519 | -0.08689922 | 0.29855523 | 0.23373209 | 0.84070907 | 0.04056246 | 0.81629084 | 0.09405984 | 0.44648249 | 0.19372711 | 0.39702472 | 0.2871634 | 0.18336344 | -0.23229017 | 0.51825276 | -0.01438695 | 0.97288528 | -0.0465787 | 0.74343519 | -0.11955714 | 0.19244917 | -0.36704854 | 0.07973185 | -0.85698213 | 0.00573545 | -0.53176608 | 0.02000708 | -0.28857465 | 0.10907767 | 0.19196284 | -0.1863804 | 0.20981138 | 3.2401E-4 | 0.81360234 | 0.03684804 | 0.85579378 | -0.24431246 | 0.52085897 | -0.02515768 | 0.66558566 | -0.1126364 | 0.31768897 | -0.27812141 | 0.00206128 | -0.0468863 | 0.21299115 | -1.07336425 | 0.28634183 | -0.15597895 | 0.6423311 | -0.25578248 | 0.05817991 | 0.07208429 | 0.52240542 | 0.24143135 | 0.01265039 | 0.32075409 | 0.00306117 | 0.06933806 | 0.76409927 | 0.12317386 | 0.83182097 | -0.10083509 | 0.76765932 | -0.38892625 | 0.05950895 | -0.05189763 | 0.47104286 | -0.98576571 | 2.2716E-4 | 0.56203178 | 3.373E-4 | |||||||||||||
| 175.026 | Ascorbate [-H(+)] | cpd:C00072 | 0.1105814 | 0.61702365 | -0.1669945 | 0.10929703 | -0.04820669 | 0.25129323 | 0.00426952 | 0.35096973 | 0.12022397 | 0.54119315 | 0.35442923 | 0.09833873 | 0.20013003 | 0.03439038 | 0.04550844 | 0.66927134 | -0.02614965 | 0.5430798 | 0.01137089 | 0.59511646 | 0.31411837 | 0.10929703 | -0.61490106 | 1.243E-4 | -0.1784748 | 0.04540605 | -1.05589003 | 4.4158E-4 | -0.77720132 | 0.03153715 | -0.09335846 | 0.31586495 | 0.32822921 | 1.0926353 | 0.01497485 | 0.25392027 | 0.07674925 | 0.10198084 | 0.12580753 | -0.19265658 | 0.09299808 | -0.01829859 | 0.79282991 | -0.00427201 | 0.64359093 | -0.2289369 | 0.01591348 | -0.54234063 | 0.1108797 | -0.1239259 | 0.28349151 | -0.05090333 | 0.5692505 | -0.52122018 | 0.00215432 | -0.18789273 | 0.2715647 | 0.16767472 | 0.24291889 | 0.0094516 | 0.41753472 | 0.16655471 | 0.49544738 | -0.03273644 | 0.56510643 | 0.42857973 | 0.39189773 | -1.43791207 | 0.00647959 | 0.0996626 | 0.38280539 | -0.34102059 | 0.03973874 | 0.42194473 | 0.00593794 | |||||||||||||
| 525.996 | ATP [+F(-)] | cpd:C00002 | dGTP [+F(-)] | cpd:C00286 | -0.20204059 | 0.03245911 | 0.09350403 | 0.71753687 | 0.29452533 | 0.00519194 | -0.14111059 | 0.05252539 | -0.14535112 | 0.20943171 | 0.0613915 | 0.46681848 | -0.00709231 | 0.66563256 | 0.24755139 | 0.22971113 | 0.10839199 | 0.59870953 | 0.12276907 | 0.17101934 | -0.39780557 | 0.00300532 | 0.02963408 | 0.34457848 | -0.21835174 | 0.00599904 | 0.25936218 | 0.03163141 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 505.991 | ATP [-H(+)] | cpd:C00002 | dGTP [-H(+)] | cpd:C00286 | 0.27530848 | 0.6629565 | 0.99940105 | 7.6937E-4 | 0.22948762 | 0.00199293 | 0.04256925 | 0.78693885 | -0.41447265 | 0.13048998 | -0.32752489 | 0.09586093 | -0.56988696 | 0.38736298 | 0.99546229 | 3.7905E-4 | 0.26915738 | 0.30725587 | 0.38303763 | 0.45773148 | -1.28690342 | 7.69E-4 | -0.76606092 | 0.49863535 | -0.80736223 | 0.01572696 | 1.62758297 | 0.00109019 | -0.28538185 | 0.08515453 | -1.17814078 | 0.03327889 | 0.09010969 | -1.55685925 | 5.8E-7 | -0.27790994 | 0.97919564 | 0.37662712 | 0.00472696 | 0.50043753 | 0.3445483 | -0.34739021 | 0.53289906 | -0.2604515 | 0.58586981 | 0.42496673 | 0.0019612 | -0.86662224 | 3.1894E-4 | 0.16294578 | 0.82539899 | 0.1101839 | 0.63808916 | 0.06755107 | 0.5010519 | -0.1416412 | 0.28069376 | -0.29316707 | 0.02227029 | -0.01079471 | 0.91983648 | 0.23286174 | 0.09441112 | -0.04036575 | 0.46952153 | 0.03993269 | 0.84385859 | -0.09096711 | 0.62757828 | -0.20001051 | 0.899 | -0.03753748 | 0.94660784 | -0.23830408 | 0.30809245 | |||||||||||
| 159.977 | Carbamoyl phosphate [+F(-)] | cpd:C00169 | -0.59260393 | 0.0386936 | -0.79101153 | 0.00576915 | 0.80840549 | 0.71067888 | -0.02689015 | 0.97244526 | 1.29705735 | 0.52367375 | -0.27261337 | 0.35787177 | 0.29163802 | 0.91422967 | 1.69591403 | 0.42895968 | 1.55858909 | 0.45657094 | 1.14550797 | 0.71779283 | -0.01863548 | 0.00576915 | -0.23519865 | 0.5302783 | -0.74888423 | 0.03475782 | -0.61133934 | 0.077841 | -0.84779097 | 0.02110785 | -0.22867442 | 0.02200212 | 0.02617645 | 0.07169639 | 0.3321959 | 0.15114475 | 0.17290337 | 0.0271191 | 0.83752885 | 0.03310979 | 0.88902337 | -0.2333819 | 0.68812929 | -0.29228731 | 0.11315498 | -0.36936129 | 0.02506834 | -0.04929446 | 0.92460498 | -0.05760432 | 0.3750703 | -0.08677985 | 0.39819578 | -0.32939125 | 0.0746441 | -0.06086555 | 0.66224484 | 0.00580022 | 0.61826865 | 0.02935625 | 0.91630085 | -0.07388983 | 0.55673557 | -0.09747846 | 0.78978455 | 0.1780489 | 0.46154406 | -0.85868785 | 0.13581244 | -0.14373923 | 0.83646944 | -0.15583025 | 0.41231081 | 0.62331833 | 7.4236E-4 | |||||||||||||
| 139.975 | Carbamoyl phosphate [-H(+)] | cpd:C00169 | -0.06855032 | 0.933342 | 0.23763895 | 0.97753246 | -0.02046639 | 0.34826042 | 0.17469829 | 0.12813254 | 0.43075059 | 0.16447345 | 0.36319241 | 0.01151808 | 0.32843775 | 0.06612041 | 0.25282141 | 0.0726997 | -0.20067405 | 0.04367249 | 0.55367174 | 0.30913456 | 0.73916462 | 0.25257024 | 0.37420645 | -0.12260297 | 0.20946088 | 0.09515481 | 0.69734762 | 0.93333138 | 0.14063836 | 0.77768469 | 0.06690808 | 0.54344845 | -0.0811366 | 0.47374908 | 0.11760594 | 0.71021701 | -0.16895104 | 0.6709862 | -0.22693642 | 0.39872829 | -0.09630655 | 0.39963078 | 1.2068669 | 4.0649E-4 | ||||||||||||||||||||||||||||||||||||||||||||
| 402.011 | CDP [-H(+)] | cpd:C00112 | 0.51361983 | 0.09785135 | 1.03926137 | 5.836E-5 | 0.20333794 | 0.29523675 | 0.41756396 | 0.91409748 | -0.18643353 | 0.19391625 | -0.43751003 | 0.10469651 | -0.41655141 | 0.76302871 | 0.84675256 | 0.00321244 | 0.34464937 | 0.32477147 | 0.369843 | 0.39565535 | -1.12321512 | 5.84E-5 | 0.24042016 | 0.09700094 | -0.07220081 | 0.30743651 | 0.96400903 | 7.0933E-4 | 0.23361636 | 0.06122673 | -0.34151694 | 0.08270809 | 0.12381725 | -1.95065914 | 6.55E-6 | 0.15707747 | 0.26360627 | 0.26674133 | 0.2660769 | 0.17836977 | 0.76895612 | -0.31642388 | 0.22688031 | 0.00588151 | 0.62578326 | 0.32081932 | 0.09714487 | -1.84659262 | 8.068E-5 | 0.41499375 | 0.45832437 | 0.08044775 | 0.67946795 | -0.0455534 | 0.66004307 | -0.09876175 | 0.43863444 | -0.43427139 | 0.07019345 | 0.97352689 | 0.59818733 | 0.00570805 | -0.14102688 | 0.36192812 | 0.15565663 | 0.96788518 | 0.29041383 | 0.81215745 | -0.49209532 | 0.00267162 | 0.34207267 | 0.462749 | -0.72114584 | 0.00778361 | ||||||||||||||
| 507.102 | CDP-choline [+F(-)] | cpd:C00307 | 0.10084982 | 0.25072411 | 0.04529996 | 0.52752846 | 0.23186049 | 0.11303858 | -0.06589141 | 0.35969136 | 0.21573489 | 0.24783744 | 0.48831022 | 0.00614861 | 0.25885051 | 0.16398875 | 0.11485656 | 0.28761255 | 0.26033964 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 487.1 | CDP-choline [-H(+)] | cpd:C00307 | -0.05753265 | 0.94101249 | 0.60931611 | 0.08032441 | 0.10656732 | 0.39526351 | 0.16677508 | 0.58807455 | 0.09323103 | 0.42153595 | -0.11504174 | 0.08390496 | 0.05743573 | 0.25310844 | 0.58553856 | 0.00395065 | 0.16070869 | 0.51312301 | 0.15112935 | 0.41662241 | 0.19037999 | 0.08032441 | 1.29970273 | 8.658E-5 | 0.28005474 | 0.07089414 | 0.10937526 | 0.32942183 | 0.38970986 | 0.06509854 | -0.07196651 | 0.38836421 | 0.94763999 | 1.06484343 | 4.1271E-4 | -0.11016361 | 0.13909787 | -0.1354563 | 0.02735748 | 0.12913597 | 0.31867041 | 0.00128814 | 0.2270145 | 0.00338405 | 0.62540099 | 0.08559944 | 0.65386724 | 0.0327737 | 0.89637849 | -0.62800602 | 0.00554851 | 0.0686508 | 0.89219296 | -0.11199239 | 0.17914185 | 0.14098447 | 0.64671884 | 0.42664938 | 0.02817373 | 0.52417363 | 0.00135544 | -0.42755157 | 0.65693708 | 0.07484977 | 0.45403771 | 0.63275476 | -0.47154201 | 0.01842697 | 0.0522201 | 0.46687256 | -0.65052328 | 0.00138976 | 0.11686208 | 0.129832 | ||||||||||||||
| 203.068 | Choline phosphate [+F(-)] | cpd:C00588 | 0.01696408 | 0.64891526 | -0.22679997 | 0.00339659 | -0.31602861 | 0.26010476 | -0.08881931 | 0.51614547 | -0.26196967 | 0.16438657 | 0.05939753 | 0.80751166 | -0.10699731 | 0.460824 | -0.33956478 | 0.18340372 | -0.25225776 | 0.24100547 | 0.04699462 | 0.25372551 | 0.40770936 | 0.00339659 | -0.17179399 | 0.00728933 | 0.59665225 | 0.00560062 | 0.36011301 | 0.02726885 | -0.14671693 | 0.53549179 | -0.0581763 | 0.3957882 | -0.12753262 | 0.50145517 | -0.45038209 | 0.11434232 | 0.29358975 | 0.60109355 | 0.00519088 | 0.81302387 | 0.21564269 | 0.00759979 | 0.1053702 | 0.47292183 | 0.10527706 | 0.13426479 | 0.32532602 | 0.00592517 | -0.84098275 | 0.00660611 | ||||||||||||||||||||||||||||||||||||||
| 183.067 | Choline phosphate [-H(+)] | cpd:C00588 | -0.01564997 | 0.3880163 | -0.77265229 | 0.03714907 | -0.23094525 | 0.17427264 | -0.31063056 | 0.03156427 | -0.01209657 | 0.81707699 | -0.09710931 | 0.78638459 | -0.00492011 | 0.80465644 | -0.29537403 | 0.30216492 | -0.10557939 | 0.56233888 | -0.2067214 | 0.98775642 | -0.53913361 | 0.08975902 | -0.26443651 | 0.78823488 | -0.3963982 | 0.03528858 | 0.6376457 | 0.0051983 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 342.05 | CMP [+F(-)] | cpd:C00055 | -0.12383164 | 0.52679871 | -0.10884448 | 0.12239211 | 0.13583979 | 0.44670231 | -0.39034492 | 0.05356794 | -0.18174302 | 0.03257619 | 0.08607401 | -1.25109479 | 3.96E-4 | 0.03660306 | 0.65060357 | 0.19186365 | 0.00245425 | -0.16721366 | 0.36224477 | 0.01324769 | 0.51892687 | -0.1594996 | 0.11566565 | -0.11938013 | 0.21451687 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 322.045 | CMP [-H(+)] | cpd:C00055 | 0.4834801 | 0.09468631 | 0.97912677 | 0.04862998 | -0.19179039 | 0.00178397 | -0.15394308 | 0.36687446 | -0.18762561 | 0.14311513 | 0.00796311 | 0.89388088 | -0.11417084 | 0.55268495 | -0.2050127 | 1.0667E-4 | -0.13743341 | 0.38592718 | 0.04955646 | 0.41826822 | 0.11014124 | 0.04862998 | 0.02151884 | 0.53913643 | 0.14408462 | 0.17953193 | -0.13893721 | 0.02075472 | -0.29359042 | 0.00799306 | -0.0442581 | 0.34619383 | 0.15938054 | -0.31115934 | 0.00894291 | 0.09054346 | 0.02858274 | 0.11812015 | 0.48023066 | -0.13545785 | 0.19422336 | -0.01567211 | 0.14885595 | 0.04694549 | 0.40658738 | 0.08049741 | 0.34935864 | 0.07022774 | 0.2653814 | 0.26083 | 0.0502931 | 0.09305902 | 0.48760378 | -0.12394027 | 3.963E-4 | -0.11690307 | 0.17702286 | -0.04647897 | 0.18099722 | 0.01503899 | 0.03583523 | 0.1400189 | 0.03009209 | -0.17748685 | 0.28525851 | 0.18143441 | 0.29464674 | 0.27819701 | 0.0221244 | -0.0773 | 0.41490053 | 0.2046577 | 1.0232E-4 | -0.81662197 | 0.00291909 | |||||||||||||
| 766.11 | CoA [-H(+)] | cpd:C00010 | 0.22018727 | 0.30979525 | 1.18236615 | 0.40698347 | 0.32744685 | 0.41241156 | 0.1383891 | 0.61997575 | 0.61137492 | 0.61303351 | 1.27741774 | 8.942E-5 | 0.34220358 | 0.9111199 | 0.03523805 | 0.55620186 | -1.02258579 | -0.78972901 | 0.00248288 | -0.4535347 | 0.01565741 | 0.1762848 | 0.19306937 | -0.00467979 | 0.29778411 | 0.25786313 | 0.78549602 | 0.25960119 | 0.42799711 | 0.47797501 | 0.00796682 | -0.20118884 | 0.91205637 | 0.3012939 | 0.89973483 | -0.05140918 | 0.59006847 | -0.15035078 | 0.20620672 | -0.15458193 | 0.0646 | -0.636322 | 0.00498765 | -0.73253328 | 4.9502E-4 | |||||||||||||||||||||||||||||||||||||||||||
| 501.978 | CTP [+F(-)] | cpd:C00063 | -0.16496009 | 0.00736997 | 0.37392894 | 0.0459038 | 0.27142295 | 0.05039496 | -0.12361275 | 0.02035797 | -0.04568372 | 0.39370389 | -0.05145305 | 0.14517778 | -0.02135552 | 0.86196941 | 0.30619977 | 0.00267388 | 0.06955634 | 0.99883179 | 0.21741336 | 0.39745583 | -0.29687165 | 0.0428238 | -0.11466519 | 0.71010108 | 0.20644004 | 0.02149358 | -0.11644628 | 0.16217276 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 481.978 | CTP [-H(+)] | cpd:C00063 | 0.52420655 | 0.05132596 | 1.81360477 | 3.387E-5 | -0.15043973 | 0.44766019 | -0.18836877 | 0.4043294 | -0.18834965 | 0.46670225 | -0.19482724 | 0.03581253 | -0.00576559 | 0.78788198 | 0.4899685 | 0.01994179 | 0.34120408 | 0.22017074 | 3.6863E-4 | 0.69782426 | -0.65301153 | 3.39E-5 | -0.168311 | 0.03183507 | -0.09645372 | 0.24317088 | 0.02714691 | 0.66985424 | -0.37007321 | 0.04284107 | -0.10258245 | 0.31971892 | -0.01037454 | 0.58002354 | -0.03841977 | 0.52818719 | 0.2272729 | 0.0644839 | 0.00923252 | 0.48410597 | 0.17764349 | 0.76796221 | -0.54241573 | 0.0118782 | -0.12549065 | 0.73521536 | -0.14126295 | 0.11423658 | 0.33081387 | 0.00483966 | ||||||||||||||||||||||||||||||||||||||
| 677.1 | Cyclic di-3',5'-adenylate [+F(-)] | cpd:C20565 | -0.21828147 | 0.10540373 | -0.16467146 | 0.33312882 | -0.25222654 | 0.09457454 | -0.27689439 | 0.03690527 | 0.11910381 | 0.58043967 | -0.37960313 | 0.19842152 | -0.11155221 | 0.42458151 | -0.29514866 | 0.30096645 | 0.1241857 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 657.094 | Cyclic di-3',5'-adenylate [-H(+)] | cpd:C20565 | -0.20426411 | 0.18633547 | -0.20689498 | 0.16582959 | 0.16582959 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 242.079 | Cytidine [-H(+)] | cpd:C00475 | -0.06606619 | 0.67786086 | 0.01229521 | 0.42348772 | -0.02943723 | 0.11005896 | -0.08626096 | 0.71775072 | 0.03738008 | 0.88595688 | -0.04968551 | 0.61755094 | -0.11422836 | 0.17584324 | 0.13771544 | 0.26995675 | 0.08876791 | 0.52902471 | 0.20997298 | 0.00643068 | 0.15291667 | 0.42348773 | 0.24618082 | 0.02751374 | 0.38606559 | 7.6767E-4 | -0.58183137 | 0.09638031 | 0.04174231 | 0.67637266 | 0.0015435 | 0.42791463 | 0.50165178 | 0.19560927 | 0.00836737 | 0.03478804 | 0.48783338 | -0.35348061 | 0.08796422 | -0.11222505 | 0.31294805 | 0.02501098 | 0.87096527 | 0.11062394 | 0.0053409 | 0.00559689 | 0.82408533 | 0.02772491 | 0.64695794 | 0.34627929 | 0.00222131 | 0.43910667 | 0.00375855 | -0.02505155 | 0.83037568 | 0.12859781 | 0.06561273 | 0.09484342 | 0.08309079 | 0.17901432 | 0.00111621 | 0.02645456 | 0.85256754 | -0.07976139 | 0.80537704 | -0.05070789 | 0.26152112 | 0.16072842 | 0.01023611 | -0.2786805 | 0.07753499 | -0.28857312 | 0.00325223 | -0.51367176 | 1.2E-4 | |||||||||||||
| 430.036 | dADP [+F(-)] | cpd:C00206 | 0.07284948 | 0.88643043 | -0.90721938 | 0.01699012 | -0.59826761 | 0.00107617 | -0.32162292 | 0.02062139 | -0.22659307 | 0.04433734 | 0.19747421 | -0.30386236 | 0.13248642 | 0.16409823 | 0.68176735 | 0.02550267 | 0.60449692 | 0.01651191 | 0.91600553 | -0.20799551 | 0.64918993 | -0.07255004 | 0.54675057 | -0.14388703 | 0.33443723 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 410.027 | dADP [-H(+)] | cpd:C00206 | -0.30222853 | 0.36076762 | 0.17450477 | 0.08532935 | 0.45045692 | 0.06108647 | 1.00803195 | 0.44842232 | -0.0772725 | 0.33340912 | -0.47615302 | 0.06983397 | -0.19686626 | 0.48569883 | 0.83439905 | 0.01285249 | 0.28110406 | 0.20148232 | 0.29323028 | 0.95146753 | -1.34119759 | 0.08532935 | -0.59271959 | 0.02308555 | -0.39281507 | 0.22052794 | 0.46009019 | 0.00743249 | -0.79835126 | 0.00118535 | -0.27443684 | 0.03967561 | 0.55718219 | -1.59211988 | 4.9072E-4 | 0.139878 | 0.41954859 | 0.38092673 | 0.23290037 | -0.17965941 | 0.83435439 | -0.37559006 | 0.07958244 | -0.11943333 | 0.2695072 | 0.00347637 | 0.5844888 | -1.73010821 | 1.809E-5 | 0.01709572 | 0.77658655 | -0.12739853 | 0.79718346 | -0.18101315 | 0.35250978 | -0.20131612 | 0.03266586 | 0.10301692 | 0.81826476 | 0.26660961 | 0.08665949 | 0.49520243 | 0.03091113 | -0.1269785 | 0.45455123 | -0.00186901 | 0.98136182 | -0.11611834 | 0.84099536 | -0.79598446 | 0.0013021 | 0.22705688 | 0.50676839 | -0.51740805 | 0.01489497 | |||||||||||||
| 330.062 | dAMP [-H(+)] | cpd:C00360 | -0.38539402 | 0.03465831 | -0.43568831 | 0.34775166 | -0.08227466 | 0.49614691 | -0.02318838 | 0.94635704 | -0.23432898 | 0.25407055 | 0.26824014 | 0.28811849 | -0.03227732 | 0.98800901 | 0.24232029 | 0.01995723 | -0.04947707 | 0.915139 | 0.11977168 | 0.52826707 | -0.42253251 | 0.34775166 | -0.84077636 | 0.01096537 | -0.68948879 | 0.0039704 | -0.21662147 | 0.55027849 | -0.84888266 | 0.00423652 | -0.41366488 | 0.0228312 | 0.18650392 | -0.84264895 | 0.0117583 | 0.12792076 | 0.93013212 | 0.54201279 | 0.21258869 | 0.08182419 | 0.32501319 | -0.39569561 | 0.32164184 | -0.09608203 | 0.16249422 | 0.05611864 | 0.6871962 | -0.75777143 | 1.5903E-4 | -0.3728485 | 0.41968873 | -0.22772968 | 0.98657544 | -0.15471249 | 0.07798323 | -0.27638308 | 0.0901069 | 0.16818099 | 0.17677312 | 0.64211769 | 0.00236593 | 0.54581428 | -0.04326313 | 0.97755377 | -0.03226352 | 0.87041256 | -0.00443133 | 0.36168489 | -0.39415781 | 0.07633666 | 0.1612988 | 0.51080749 | -0.11401304 | 0.29990585 | ||||||||||||||
| 510.004 | dATP [+F(-)] | cpd:C00131 | -0.10138306 | 0.06924091 | -0.18623951 | 0.0501102 | 0.02552352 | 0.51160077 | -0.18523482 | 0.0460169 | -0.06789135 | 0.77128027 | 0.22134703 | 0.02119122 | 0.12936736 | 0.38864949 | -0.02991972 | 0.74821185 | 0.08483961 | 0.18316091 | 0.11434798 | 0.82241166 | -0.01555812 | 0.88404789 | 0.07745727 | 0.65860321 | -0.05618294 | 0.2390208 | 0.43179671 | 0.17579294 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 489.993 | dATP [-H(+)] | cpd:C00131 | 0.2395494 | 0.60021818 | 1.21632615 | 0.00434488 | 0.39104279 | 0.04593723 | 0.78385011 | 0.60418959 | -0.13745584 | 0.61567559 | -0.21516313 | 0.2499394 | -0.03316452 | 0.73738009 | 0.42945641 | 0.16430365 | 0.16093648 | 0.53986175 | -0.10537475 | 0.7972424 | -0.63848118 | 0.00434488 | -1.45753969 | 4.924E-5 | 0.45447561 | 0.19215964 | 0.02015619 | 0.69991125 | -0.06334514 | 0.4606165 | -0.11032737 | 0.49438975 | -0.27823734 | 0.4443486 | -0.03644778 | 0.77400025 | 0.32801606 | 0.22920384 | -0.01593557 | 0.63349005 | 0.05941623 | 0.82315323 | -0.01590989 | 0.25956558 | -0.33610498 | 0.10116172 | 0.17865325 | 0.56052572 | -0.31856688 | 0.01040997 | ||||||||||||||||||||||||||||||||||||||
| 406.017 | dCDP [+F(-)] | cpd:C00705 | 0.20398213 | 0.39950724 | 0.34026099 | 0.0902391 | 0.0902391 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 386.016 | dCDP [-H(+)] | cpd:C00705 | -0.45665438 | 0.10492194 | -0.93732129 | 3.564E-5 | 0.46326121 | 0.0614286 | 0.7654926 | 0.43170771 | -0.03474641 | 0.70081818 | -0.46644373 | 0.05298001 | -0.22907971 | 0.69190407 | 1.05560536 | 0.00358687 | 0.60500808 | 0.10185886 | 0.57413689 | 0.42039469 | -0.87016392 | 3.56E-5 | -0.21991043 | 0.09967449 | 0.00118077 | 0.55856936 | 0.2423582 | 0.09627699 | -0.38964918 | 0.00428562 | -0.53278697 | 0.00199908 | 0.04417909 | -1.21221179 | 0.00106102 | -0.01226472 | 0.95163893 | 0.24757497 | 0.05807338 | 0.14739959 | 0.77331014 | -0.40855233 | 0.32867702 | -0.05779645 | 0.86506643 | 0.14986206 | 0.28069713 | -1.57182717 | 6.297E-5 | 0.20128804 | 0.72908295 | 0.01963345 | 0.81931858 | -0.27733269 | 0.25706071 | -0.27837623 | 0.00284275 | -0.0386271 | 0.92916923 | 0.18331895 | 0.05244857 | 0.49024872 | 7.097E-5 | -0.0075881 | 0.62606691 | 0.12842191 | 0.7167092 | 0.10969841 | 0.96729185 | -0.84912643 | 0.00252 | 0.25965323 | 0.4591691 | -0.58441064 | 0.00468888 | |||||||||||||
| 326.059 | dCMP [+F(-)] | cpd:C00239 | -0.11046422 | 0.3212767 | -0.06073076 | 0.82013283 | 0.19091483 | 0.0646147 | -0.07698109 | 0.22231792 | 0.02674263 | 0.68941073 | 0.15023841 | 0.01076334 | 0.13549186 | 0.0113214 | -0.05780534 | 0.82901161 | 0.1046092 | 0.10924754 | 0.04571312 | 0.95254477 | -0.46042244 | 4.1338E-4 | -0.0389839 | 0.58392313 | -0.218275 | 0.01991374 | -0.0133577 | 0.39454774 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 306.049 | dCMP [-H(+)] | cpd:C00239 | -0.03575897 | 0.21823261 | -0.65789701 | 0.00426293 | -0.02672863 | 0.45222557 | 0.02421935 | 0.87401414 | -0.0679155 | 0.10302716 | 0.07971409 | 0.52699009 | 0.11755902 | 0.25689445 | 0.28658904 | 0.00306349 | 0.13124378 | 0.22828024 | 0.0222254 | 0.51733822 | -0.13643743 | 0.00426293 | -0.49133962 | 0.01267228 | -0.44492961 | 0.01148078 | -0.53844775 | 6.2001E-4 | -0.5023822 | 0.00668888 | -0.33602048 | 0.00443601 | 0.01430897 | -0.41445413 | 0.01118297 | 0.01781805 | 0.30240109 | 0.17940779 | 0.42585937 | -0.04521677 | 0.84166274 | -0.08459194 | 0.44760583 | -0.24871018 | 0.04015199 | -0.01800839 | 0.81226118 | -0.20749706 | 0.01504541 | -0.40149146 | 0.0382416 | -0.1402765 | 0.40388975 | -0.33991584 | 0.01025288 | -0.20438706 | 0.09913363 | 0.24734658 | 0.10525101 | 0.31028861 | 0.00113752 | -0.13850654 | 0.83906838 | 0.1213509 | 0.93334291 | 0.9895265 | -0.21220099 | 0.1655674 | -0.04063109 | 0.6394666 | -0.01434934 | 0.56848577 | 0.03160417 | 0.74163739 | ||||||||||||||
| 465.981 | dCTP [-H(+)] | cpd:C00458 | 0.34711175 | 0.30356855 | 0.65819882 | 0.00321326 | 0.28422658 | 0.13599315 | 0.27646842 | 0.58613103 | -0.07771849 | 0.20507815 | -0.05398121 | 0.21766899 | 0.03539659 | 0.65429459 | 0.39018436 | 0.08000036 | 0.28758236 | 0.17440038 | 0.14707178 | 0.76656407 | -0.87451393 | 0.00321326 | -0.38804566 | 0.10207434 | 0.10417097 | 0.95811155 | -0.00978674 | 0.72265254 | -0.22725941 | 0.09156458 | -0.11909668 | 0.71441889 | -0.09121503 | 0.1347153 | 0.06898357 | 0.3445615 | 0.15637682 | 0.17651363 | 0.10571373 | 0.86963117 | 0.08033033 | 0.74556285 | -0.14507683 | 0.13835856 | -0.20277349 | 0.78834763 | 0.0070733 | 0.93523807 | -0.04938972 | 0.7041351 | ||||||||||||||||||||||||||||||||||||||
| 684.097 | Deamino-NAD+ [+F(-)] | cpd:C00857 | -0.43967688 | 0.04601636 | -0.22428263 | 0.34096546 | 0.15201577 | 0.12056583 | -0.27934153 | 0.05278858 | -0.27584212 | 0.03719707 | -0.03213205 | 0.71206579 | 0.11350646 | 0.19448672 | 0.07145314999999999 | 0.35451861 | 0.11023537 | 0.59719701 | -0.05756975 | 0.91124527 | -0.17675446 | 0.02481629 | 0.01356927 | 0.67334734 | -0.2358358 | 0.04486973 | -0.12585969 | 0.22849579 |
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| # Fold Change values, corrected using median metabolite fold change values per batch | |||||||||||||||||||||||||||||||||||||||||||
| m/z | metabolite | KEGG_ID | M129_timecourse_6h_3 | M129_timecourse_24h_3 | M129_timecourse_48h_3 | M129_timecourse_96h_3 | 24h_timecourse_4 | 48h_timecourse_4 | 6h_timecourse_4 | TF173_MPN303_5 | TF178_MPN250_5 | TF187_MPN674_5 | Tn051_MPN051_5 | Tn674_N/A_5 | WT_WT_5 | dldh,NoxE_N/A_5 | AA_perturbation_6 | Fe_perturbation_6 | Glu_perturbation_6 | Gly_perturbation_6 | KO51_mutant_6 | Ox_perturbation_6 | TF173_mutant_6 | TF183_mutant_6 | TF414_mutant_6 | TF462_mutant_6 | TF463_mutant_6 | Tn674_mutant_6 | blank_control_7 | Gly_ctrl_perturbation_7 | TF173_mutant_7 | TF178_mutant_7 | TF184_mutant_7 | TF187_mutant_7 | TF413_mutant_7 | TF462_mutant_7 | TF463_mutant_7 | Tn051_Gly_perturbation_7 | Tn674_mutant_7 | WT_perturbation_7 | WT_noGluc_perturbation_7 | water_control_7 | |
| 59.015 | Acetate [-H(+)] | cpd:C00033 | -0.38309088349117776 | -0.24502827641689928 | -0.4215271813109894 | -0.4818393537021034 | -0.01947578110400312 | -0.12388788971801633 | 0.05882502088091938 | 0.059102879542463876 | -0.10536150985152733 | 0.031436907813676106 | 0.021605983530742556 | -0.03067087434531776 | 0.09274432005739001 | -0.028755125601739696 | -0.0403007057865455 | -0.06927937544596593 | -0.167564042898101 | 0.01910405329435474 | -0.10031271787098449 | 0.04205588204545683 | 0.030585652286198077 | 0.04033957441728828 | -0.013343297208889495 | -0.017391731631137695 | -0.03643772250293227 | -0.07904757487908166 | 0.0625642805490718 | -0.007906452819794484 | -0.01440594166677624 | 0.011525410493217064 | 0.04748193877973946 | 0.10435391638349 | -0.012816696834782775 | 0.003233746514214743 | 0.03874313777471085 | -0.06785373039562223 | 0.039218010391003144 | 0.058099334478775834 | -0.3305592946743406 | -0.05061857063717055 | |
| 74.026 | Glycine [-H(+)] | cpd:C00037 | 0.1820370485946288 | 0.12866076673213317 | 0.19106610722035278 | 0.054437624855208325 | -0.01525459017112366 | -0.020371958704962365 | 0.02437656509844275 | -0.031399810925419006 | 0.016373006212227228 | -0.007601395443010596 | 0.019196790642003424 | -0.038057827844730954 | 0.002435641570153449 | -0.03373135004110623 | 0.5393785522965779 | 0.06001489057303865 | -0.05383681341398171 | -0.02381991957220906 | 0.00781867823499112 | 0.020019046380948206 | 0.029891213385372695 | 0.017830613191131488 | -0.03879759631641364 | -0.037953968844946874 | -0.03307017453188319 | -0.004211147248307496 | -0.049206137824010766 | 0.016592654611596272 | -0.04316611178707787 | 0.030651607656958513 | 0.03888693260683889 | 0.04345943632194562 | -0.0023607580919546792 | 0.03918816324014978 | -0.0051843497623533675 | -0.0295454172308 | 0.061941909786680786 | -0.007875746436498519 | -0.10928498135786903 | -0.12275864589650202 | |
| 87.007 | Pyruvate [-H(+)] | cpd:C00022 | -0.05566462229705214 | 0.4373519696639668 | 0.3688805074484839 | 0.5232352761205669 | 0.14520993436678092 | -0.13444146454785744 | 0.10942021803801302 | -0.038339629611253964 | 0.07615552993464432 | 0.0468947622189645 | -0.03040069355903066 | 0.015066991615010007 | 0.04783146549143492 | 0.01614378531383446 | -0.09402316903570299 | 0.15819648841734085 | -0.175215839722713 | -0.06239134794591071 | -0.24423338258334948 | -0.20354198346099944 | 0.10114490438905065 | 0.07569837196261492 | 0.07224210108547233 | 0.13721825632168894 | 0.09636861356933546 | -0.011088200225988915 | -0.002457190521589193 | 0.03971466399624825 | -0.08212762943947473 | -0.008050189151970078 | 0.05319565302395783 | 0.07089459226713389 | -0.07239233692620627 | -0.002978534026689674 | 0.05968321921317214 | -0.06419016679234643 | -0.003470110333048138 | 0.048174396688957684 | -0.10007281185921035 | 0.2309583682827666 | |
| 88.041 | L-Alanine [-H(+)] | cpd:C00041 | 0.0923174760368027 | 0.0870929440394207 | 0.04336355669904195 | 0.08952728189735192 | 0.018628206440604193 | -0.00554261393826106 | 0.00399124754819747 | 0.018043822291201116 | -0.06759280017121314 | 0.024121514334668616 | -0.007749606111085432 | -0.06545557607338925 | 0.0738275636515004 | -0.026352543261318417 | -0.014724061407655892 | 0.004143696523339653 | -0.02629243670384835 | 0.05370179695408366 | -0.011448599420759086 | -0.007401135221053821 | -0.0049889382373305945 | -0.003987019979759356 | -0.0126254470756514 | 0.006236600726531622 | 0.008200753478620156 | -0.021421804154227668 | -0.005942320186564538 | 0.00592846139824815 | -0.006917602774163594 | 0.0043026515486138395 | 0.0012138804573009556 | 0.009572069374902029 | 0.013722737514408162 | 0.0051038422256878225 | 0.021365048438343158 | -0.010283909284438753 | 0.0023657705929193986 | 0.007824027579092466 | -0.023041656896429064 | -0.0068692878000148816 | |
| 89.026 | Glycerone [-H(+)] | cpd:C00184;(S)-Lactate [-H(+)];D-Glyceraldehyde [-H(+)];cpd:C00577;cpd:C00186 | 0.6451405491756192 | 0.46684834047876606 | 0.40946005052795253 | 0.6630036931445182 | -0.0023139223432213953 | 0.06552242158687789 | -0.038782428018959404 | 0.038735110345882465 | -0.0466640277363345 | 0.03115075454144904 | -0.011421285089509384 | -0.035857972577101535 | 0.08960432145884256 | -0.019142295895986854 | 0.01808812955044084 | 0.059438297488711864 | -0.1323212439517691 | 0.044101554339212555 | -0.06765222481763432 | -0.05148304553647589 | -0.054405058837100555 | -0.05368516749857306 | -0.044716243987479226 | 0.05012569657982341 | 0.006737415036471685 | -0.06783317550596822 | -0.00741093614538863 | 0.08564386951993767 | -0.07031555698131513 | -0.0019470021807774325 | 0.08578271299382927 | 0.0480736000792192 | 0.011441231132804796 | 0.020600569360630237 | 0.05182694247294942 | -0.11406987642642859 | 0.05011742898727205 | 0.05215323146167311 | -0.127622592901674 | -0.07116467136623623 | |
| 91.04 | Glycerol [-H(+)] | cpd:C00116 | -0.23671045507097957 | -0.17052884612055363 | -0.16326430848061846 | -0.08060323344433973 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.19423658299465058 | 0.0021383505841913023 | -0.0757068343886088 | 1.290427318065046 | -0.20736489523851515 | -0.08610820303524848 | -0.023313525282210795 | 6.840103288701342E-4 | 0.024180335266489817 | 0.014625370363436682 | 0.10458557067161485 | 0.055721764906836654 | 0.046558789484867164 | 0.9991159859431891 | -0.09188726792292401 | -0.007465447183584272 | 0.01737246653405341 | 0.027949817843224024 | -0.0749472876230555 | 0.006166523270665844 | -0.01640840683204704 | 0.35344338241950574 | 0.13142370051300578 | 0.055497456707197676 | -0.10865687262894534 | 0.18327224929779978 | |
| 94.03 | Glycine [+F(-)] | cpd:C00037 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -0.00383030060000823 | -0.14233804581635728 | 0.040282661269681296 | 0.035047845842384816 | -0.04820251643966124 | 0.12316391408340151 | 0.04360468068313973 | 0.019453864279372162 | -0.01674501076138955 | -0.040439399544263545 | 0.07939177816538832 | -0.04097626357414381 | 0.12106444382335137 | 0.007242339479869909 | 0.07005958955560251 | 1.39464446985119E-4 | -0.029875745986108402 | -0.004797252289000055 | -0.006006361069338777 | 0.061576960145997436 | -0.2188411112848714 | -0.15173478620425085 | 0.08836006680685222 | 0.1296307271252848 | 0.19867883204734413 | -0.12613078089175353 | 0.102670877571952 | -0.07526061873114678 | -0.1977071266512028 | -0.06682928349184389 | 0.020628054109472594 | -0.3735460505897582 | 0.008020825968600995 | |
| 96.97 | Orthophosphate [-H(+)] | cpd:C00009 | -0.3752026202021494 | -0.30002306184674715 | -0.26050178464456597 | -0.17239926470188094 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.037215801531227895 | 0.019969854910825487 | -0.0774630175181559 | -0.055187623819554374 | -0.16281003188864349 | -0.038131722387840246 | 0.05101535753977061 | 0.05022931644194948 | -0.010593458545131112 | -1.242694112036108E-4 | 0.009564180764276892 | 0.022613419407864415 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 104.036 | L-Serine [-H(+)] | cpd:C00065 | 0.26899926700215837 | 0.19300571453498758 | 0.11547035318885523 | 0.06025090979078353 | -0.013316956871460743 | -0.0403223726447622 | 0.05541925884872697 | 0.03859707188317326 | 0.003287148976482222 | -0.009228836126476223 | -0.015179128176508634 | -0.04787791169112804 | 0.02098789988673202 | -0.023264371703376134 | 0.3170736937728201 | 0.06398576795415495 | 0.012399309628339177 | -0.006046327308175055 | 0.006201910639725701 | -0.08730332051336955 | -0.014206098513585617 | -0.022123509075721085 | 0.01878820650074547 | 0.026095144708275345 | 0.015545140148393703 | 0.03275033990523418 | -0.058433060981064634 | -0.016049734896215726 | 0.0030546470508864905 | 0.017313152735647007 | 0.04091902114701149 | 0.016701576962254754 | 0.043206810066094226 | -5.881612925835405E-4 | 0.052191917266785806 | -0.013529361524139449 | -0.040251315911953925 | 0.0075200200955937565 | -0.10764118032473144 | -0.17823165256684995 | |
| 107.013 | Pyruvate [+F(-)] | cpd:C00022 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.062484019731432694 | -0.01356031511791883 | -0.027153553292911563 | -0.01891120254672787 | 0.036857859373257404 | 0.03879828924161005 | -0.005651937060960027 | -0.01890127595007563 | 0.005485986191196727 | -0.052607229782415416 | 0.0014075950157797772 | 0.027961483101453924 | -0.12946092848314392 | 0.08038650134403923 | |
| 108.046 | L-Alanine [+F(-)] | cpd:C00041 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.046723749397948156 | 0.0056963395452907266 | -0.0016479572733059473 | 0.03791219690822234 | -0.11098975649065361 | 0.05563655468681694 | 0.0218821791211557 | 0.04396892161789024 | 0.0221859171745367 | -0.026988467553475375 | 0.04086871077698685 | 0.009719655914946388 | 0.04104017876268718 | -0.006071725963781789 | -0.11202728295538902 | 0.027265646914539362 | 0.03288091360075165 | 0.06788656840085971 | -0.12957436952015358 | 0.03066859662264244 | -0.021394888969701 | -0.07047643735527946 | -0.10547726292284137 | 0.042051473598744275 | -0.1317159845434476 | 0.2144178610800149 | |
| 109.03 | Glycerone [+F(-)] | cpd:C00184 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.01569813727848772 | -0.005312322932603723 | -0.01499604427738048 | -0.06463802355125103 | -0.11904846262404772 | -0.05865137935264147 | 0.10403387233373483 | 0.04812735867931382 | -3.741146655007508E-4 | -0.023060908435980895 | -0.007125709844818304 | 6.617047524347749E-4 | 0.006237936850705556 | 0.06540018987872799 | -0.09035672979978691 | -0.004423513651711029 | 0.023736623243260813 | 0.05891968842951113 | -0.0905670866741552 | 0.005066727283051604 | 0.0029198952152538907 | -0.07345009526149995 | -0.015747773968233462 | 0.051403200118260245 | -0.11964569605244281 | 0.2150489593900066 | |
| 111.02 | Uracil [-H(+)] | cpd:C00106 | -0.008591689055397317 | 0.100894608900751 | 0.018504968651410676 | 0.045570103014479516 | 0.02281098453835196 | 0.027972217307591408 | -0.0366324436642315 | -0.032502773462675494 | -0.0348197881150635 | 0.06903572016005868 | 0.040883165212258 | 0.010040867415727203 | -0.012645755515423655 | 0.057212762863759425 | 0.028542566998134702 | 0.060570232412026886 | -0.06831084519717455 | -0.05080837851379499 | -0.06600011740491883 | -0.05900989235225978 | 0.008269574169561603 | -0.023605962273666323 | -0.034119938553782855 | 0.01733512333651295 | -0.0028832143857217374 | -2.979120393676237E-4 | -0.002417067192922251 | 0.026861265086183885 | -0.05665534255477308 | -0.0013208315789371018 | 0.01193582346389194 | -0.011013581733481307 | -0.0040506328781112376 | -0.025791902167029413 | 0.03084467836125246 | -0.015429232013971398 | 0.006088716093100994 | 0.03930980193961798 | 0.005850634069583566 | 0.1355732194723211 | |
| 111.045 | Glycerol [+F(-)] | cpd:C00116 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.027552156042260707 | 0.0801825983939512 | -0.10234240529343977 | 0.0027039069470936655 | 0.011153446917208983 | 0.04725955827442039 | -0.09408877620025967 | 0.001979528363820625 | 0.01206028162592282 | -0.055854255637476063 | -0.03939241361928167 | 0.0417604388650266 | -0.1214419649756724 | 0.23512802102109906 | |
| 114.056 | L-Proline [-H(+)] | cpd:C00148 | 0.22547182372874341 | 0.047143151920608466 | 0.10632590198059991 | 0.059218680813056916 | 0.006006843525114062 | 0.05424929395236766 | -0.05365112264381465 | 0.04362724748543263 | -0.07246989833076257 | -0.029732718429125667 | 0.009482522835973244 | -0.1042978708196855 | 0.01322515449553594 | -0.030301337599758678 | -0.015099704949507674 | -0.18612002839259995 | 0.22331745292946417 | 0.0044993818348873695 | 0.058334727627838284 | -0.09563789133362509 | 0.05157740379805321 | 0.12660711384618614 | 0.07286240490933593 | -0.02284286333711198 | 0.03507516466593899 | -0.07468365452176703 | -0.1826921699372189 | -0.04958636263108392 | 0.0018805862509659718 | 0.018128965848447854 | 0.003790127761120945 | 0.028848394555223502 | 0.05303365410577023 | -0.021133604283116957 | -0.00421493274236593 | -0.02821422500989728 | -0.044852725980096673 | -0.004050213655191078 | -0.0356797719659977 | 0.06699397137211774 | |
| 116.072 | L-Valine [-H(+)] | cpd:C00183 | 0.028879064743616803 | 0.03254425418880261 | 0.045681657429235314 | 0.042319657394168084 | -0.004655052426576442 | 0.017408408072806757 | -0.027331562719475483 | 0.015491539312316888 | -0.01571045908548807 | -0.0037678882595437303 | 0.00978109587761365 | -0.0012208919672829547 | -0.012820923938275398 | 0.013456870035527065 | -0.00972125297251104 | -0.003910665009370678 | 8.482903176380919E-4 | 0.04568774303989157 | 0.012890010543964261 | 0.023893576877109836 | -0.0023440486362703277 | 0.005145076623619937 | -0.016994101999587913 | 0.00954018421551352 | -0.012866533333974061 | -0.00789168011694135 | -0.028628814267902664 | 0.006609575626865611 | -0.03252765671003147 | 0.001579416861262364 | 0.002737892938959789 | -0.013140593940924703 | -0.007868484405998641 | 0.006371689120097635 | 7.995889693733274E-4 | -0.012186462345630816 | 0.017057341295463532 | 0.00940400157373748 | 0.008283109756629325 | 0.017722355790255016 | |
| 116.973 | Orthophosphate [+F(-)] | cpd:C00009 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.024844863585704993 | -0.009068428167990182 | -0.00990086537828344 | -0.012909216398842056 | 0.07129096088454219 | -2.260963337708479E-4 | 0.019764955193281853 | 0.004418631967072384 | 0.013033493987888976 | -0.12713248647127104 | 0.03519911152071774 | -0.13760784548232 | 0.02511962679011733 | 0.05320064935849998 | -0.01743458091481499 | 0.03735776071917217 | 0.09005774068710651 | -0.06318402371402326 | 0.05223259254963246 | 0.002071993137630994 | -0.0619714075878221 | -0.03762835437158475 | -0.019779105985491624 | 0.055805936650117384 | 0.05793810932722855 | 0.09236986971472533 | 0.10335732909613309 | 0.07151902064001958 | -0.02298706665422556 | -0.05533474501238327 | 0.06993983011569808 | 1.6013382916375715E-5 | -0.23222522740601906 | |
| 118.051 | L-Threonine [-H(+)] | cpd:C00188 | 0.2610574104842151 | 0.14163385138074347 | 0.14349097312674808 | 0.03604835854816565 | -0.0024520299211184967 | -6.13250831243474E-5 | 0.04846178131301517 | 0.017661417567658377 | 0.0017666053801077802 | 0.002429700551135275 | -0.008286569285745626 | -0.019930254198747534 | 0.016493473576997143 | -0.0032719976300106353 | 0.05241919934777003 | 0.03659005433600773 | -0.009945333334334547 | 0.00797240700637414 | 0.019192868129632647 | -0.027389306273986197 | -0.01421578340830017 | 0.009907267145248054 | 0.038175263021288354 | 0.011791732194494645 | 0.0159639512013139 | 0.025201571731101456 | -0.0302932221405414 | -0.03169021908849451 | 0.0030961324163669294 | 0.005756446457844455 | 0.027027355504220647 | 0.03153570803828322 | 0.021289333615570647 | 0.01406968916403605 | 0.02456165236444402 | -0.013344559718703467 | -0.02652225422324249 | 0.0022962524257639444 | -0.10387630899683861 | -0.11760857733963229 | |
| 120.012 | L-Cysteine [-H(+)] | cpd:C00097 | -0.16738045282504532 | -0.08302635736348256 | -0.0282033026740657 | -0.11198522234445929 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -0.20912539057441518 | -0.15895447208712937 | -0.10930891554633347 | -0.15235244056035926 | -0.26376159743363925 | -0.11285482813214731 | -0.10637682649815673 | 0.09205650157708332 | -0.051340871608603955 | 0.008464564594914202 | -0.0420244385615308 | -0.15828050415763037 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 122.025 | Nicotinate [-H(+)] | cpd:C00253 | -0.16837486640449537 | -0.0689391692402913 | -0.10852907537003513 | -0.07095127411080605 | 0.012735193085318869 | 0.006953022192063903 | -0.054173220467485725 | 0.019549329434098307 | -0.029315006191897912 | 0.08092093803346037 | -0.001109831037783922 | -0.03979090137418687 | 0.07957959851709558 | 0.05271653785068935 | -0.03062991839570991 | -0.011258442892156125 | -0.05188883941404623 | -0.005965428290126751 | -0.11139214261442393 | -0.005561937296892288 | -0.009637010868094655 | 0.07720925722612733 | 0.025150274240793438 | 0.005565461928588423 | 0.038278383522677345 | 0.010700820921825794 | -0.003330578544689202 | -0.13487160704343285 | -0.130140806149002 | 0.03790394998451696 | 0.09006522984973347 | 0.1406801118808723 | -0.07737865500208824 | 0.08855789501454153 | -0.011677154179134864 | -0.1452212842107951 | -0.0384406334860888 | 0.013749195373724234 | -0.27878063044472806 | 0.11470618549530119 | |
| 124.04 | L-Serine [+F(-)] | cpd:C00065 | 0 | 0 | 0 | 0 | 0.024634036981683257 | 0.009942324356295013 | -0.05649844961295563 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.043160716997216464 | -0.02464201147125043 | -0.06536606545053349 | 0.11242371409907019 | -0.043641596002963676 | 0.16030578636926887 | -0.031203477367685164 | 0.010229233164054816 | -0.026354109032481192 | 0.007117021280856682 | -0.005082305583260166 | -0.05585309473795543 | 0.03350636800865063 | -0.14091857577940223 | -0.1467633313562342 | 0.04720448447958956 | 0.09969430965850157 | 0.15014619636315382 | -0.14351949105911968 | 0.08980314625498519 | -0.06885233472176662 | -0.1641979486257732 | -0.10514156069768407 | 0.008544254433738324 | -0.27381533441674 | 0.0846515261233737 | |
| 125.036 | Thymine [-H(+)] | cpd:C00178 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.16764098592767407 | 0.028234702974493653 | -0.08612404682721644 | -0.04136474907270561 | -0.10407275231403583 | -0.03555978102050192 | 0.034551622489556316 | 0.05257932287409811 | 0.008772791285336498 | 0.02737811572708037 | 0.02654533544113544 | -0.015594830758323899 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 130.087 | L-Leucine [-H(+)] | cpd:C00123 | -0.011682594363140519 | -0.010181819019048705 | 8.628387062331938E-4 | 0.01926902718117942 | -0.0014941843853066958 | 0.028146959918624447 | -0.004760241946679146 | -0.009310391244179263 | -3.7181734405064803E-4 | 0.007043788421534881 | 0.009747912123059201 | 0.014943303565827432 | -0.014688139247177429 | 0.02404429420730686 | -0.0059755826907013756 | 2.8083830672141535E-4 | -0.018921760543786876 | 0.021339877859359403 | 0.016088316765449112 | 0.0283385109098476 | -0.008438516033701975 | -0.005021495047018309 | -0.0026065474878257276 | -0.007340129104834998 | -0.006250150077792705 | 0.005364595372380754 | -4.8329824761026157E-4 | 0.010119449304218393 | -0.0107412809904166 | -0.006865634272582784 | -0.004471594414534794 | -0.009845165617058286 | -0.013354123282666091 | 0.010613609959314789 | -0.00436125964744232 | -7.124960525343664E-4 | 0.013974814493468988 | 0.007652338388529438 | 0.01739781967084802 | 0.02754021243222279 | |
| 131.045 | L-Asparagine [-H(+)] | cpd:C00152 | 0.07008239724769655 | 0.15986260295544646 | 0.043717610556694764 | -0.026120481672105057 | 0.0023031167609967444 | -0.07171632472547577 | 0.03589103144888398 | -0.04391215268602359 | -0.020686223301319282 | 5.924899303026172E-4 | 0.019334876095569564 | 0.006409292110546368 | 0.01684348977685708 | 0.026423099870533536 | 0.6332811034923368 | 0.1478856608027756 | -0.045375108445241216 | -0.0315607251848087 | -0.07137489643301397 | -0.010409868946513285 | 0.04513030012528435 | -0.003317096537100573 | 0.03118000218281995 | 0.05839069844461341 | 0.035597212257760864 | 0.05808110909678767 | 0.03455334514306195 | 0.029864216464005087 | -0.003327002476101585 | 9.88501615067747E-4 | 0.009474959537816957 | 0.010572747808054608 | 0.002465785934302628 | -0.009842030796222444 | 0.06256254740035481 | -8.770480272221151E-5 | -0.032607143859275545 | 0.029415596787706284 | -0.06405310208176786 | -0.015816270705481146 | |
| 131.082 | L-Ornithine [-H(+)] | cpd:C00077 | 0.38830473878359795 | 0.4510912385980067 | 0.4670770176906303 | 0.30035215716541597 | 0.023292096660712965 | 0.009687989074764996 | 0.011950228389021966 | -0.00949116161503947 | 0.0694205632568731 | 0.03564276007651343 | -0.023510095376699715 | 0.03729049457197684 | -0.041799573015186206 | 8.741003009131386E-5 | 0.023781761722046577 | 0.0016170942099235583 | -0.03226877035439857 | -0.078683080881442 | -0.08434251280683645 | -0.034561893894507444 | 0.04887557364934506 | 0.027715304031317497 | -0.007517809389596574 | 0.018962307887680278 | 0.00466274795364137 | -0.004727927854953067 | 0.13269622666561334 | 0.056838108627684944 | 0.03118113999006299 | 0.07267704435125207 | -0.02568509404907195 | 0.0016763395913813345 | 0.02397352417417772 | -0.06870579625890307 | 0.019564220903493 | 0.03730424470558084 | -0.04784985877170564 | 0.007692754326603206 | -0.06910908749589961 | -0.26382381617883716 | |
| 132.03 | L-Aspartate [-H(+)] | cpd:C00049 | 0.2762173393979615 | 0.06592647373603398 | 0.17761247677314573 | 0.11297594485898357 | 0.03224523278316319 | 0.07664162541563917 | -0.08363892175344746 | 0.05226778177613987 | -0.059208024441052276 | -0.04143771870653515 | -0.023470719018885162 | -0.11610100273322863 | 0.08275941448750102 | -0.04760594356850159 | 0.011095404891757185 | -0.03241653860093154 | 0.025726789662078836 | -0.03491542395476679 | -0.04704691598635453 | -0.060654422385829895 | 0.05918525756946533 | 0.057375918074084035 | 0.04580499059790901 | 0.019045686884968896 | 0.0701532161857759 | -0.014969564547176134 | -0.14466912721454875 | -0.014035904233228293 | 0.00604992573592035 | 0.0212714832927863 | -0.0027295903574030616 | 0.04505429087488098 | 0.06716105965836515 | -0.0145219250243451 | 0.025244942949373537 | -0.04324231347864037 | -0.05891177775898659 | -0.015430181545719181 | -0.04520803817318918 | -0.17362091337470567 | |
| 134.029 | L-Homocysteine [-H(+)] | cpd:C00155 | 0.042764969978616355 | -0.030857057472765778 | -0.06318838539987218 | 0.04421886659319957 | 0 | 0 | 0 | -0.03072446224974413 | -0.09162212419639598 | 0.0465146614023706 | 0.0033512949045782954 | -0.031088539218331865 | 0.06100904796946566 | 0.06339457707755275 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 134.047 | Adenine [-H(+)] | cpd:C00147 | 0.10031534899707645 | 0.09285215744945921 | 0.13919724235363476 | 0.13730401614022264 | -0.0028425108183566562 | 0.04993135231822836 | -0.03304116397624411 | 0.006859379908489449 | -0.027817712185770872 | 1.9974128477186862E-5 | -0.0743502160709541 | -0.024454136879170703 | 0.02531668927978697 | 0.010399137295437542 | 0.31725191290434174 | 0.33066335932235114 | 0.36937709226732185 | 0.23620351403573653 | -0.2604728870028023 | 0.23893804960253703 | 0.3505330567013565 | 0.36282986195823075 | 0.3325082656607434 | 0.34362321461002876 | 0.3451173643326155 | 0.3579930228671068 | -0.09146377520049233 | -0.019178596735224658 | 0.018950464137339515 | 0.002008980574921631 | -0.016367642386226334 | -0.03716299006439693 | 0.05474680022304726 | -0.022736727035421046 | 0.020028229349587756 | -0.021074128202443483 | -0.04480260664680663 | 0.01427884421487961 | 0.04061625174909401 | 0.01913737215601949 | |
| 134.061 | L-Proline [+F(-)] | cpd:C00148 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.07266620574109152 | 0.061553844125356125 | 0.020453763452203455 | -0.015774096856223916 | -0.19272947936522594 | 0.12331175114850493 | 0.08455738708028676 | 0.07023725604915382 | 0.05679876044427214 | 0.07278405146424743 | 0.06580677206619764 | 0.06491858330885737 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 136.077 | L-Valine [+F(-)] | cpd:C00183 | 0 | 0 | 0 | 0 | 0.026974925813710474 | 0.06597091672906635 | -0.0701851955061929 | -0.12554213048978513 | -0.06736793944235915 | -0.030307046151809215 | 0.05398450666402468 | -0.03419958551204352 | -0.030107494484826438 | 0.06106109482528312 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.026042252111083967 | 0.02681544724762042 | -0.07043674251650565 | 0.007002524243732692 | 0.003650384217573804 | 9.395573968123115E-4 | -0.0948491417689027 | -0.013899671314494669 | -0.018008364041793973 | -0.047282448073217825 | -0.07522734885312175 | 0.04295846204845384 | -0.05878495107450451 | 0.15238253149971928 | |
| 138.056 | L-Threonine [+F(-)] | cpd:C00188 | 0 | 0 | 0 | 0 | 0.015198343370842169 | 0.03266110938574472 | -0.12964193727251958 | -0.06580129636832141 | -0.07576665037459977 | -0.009858818208156527 | 0.06604991349933485 | -0.00711652944392844 | -0.004887248096237661 | 0.06358510716376328 | 0.007737740916691757 | 0.031199196480343985 | -0.05869742448460059 | -0.015410962416377072 | -0.10565897071298608 | -0.006187641735777976 | 0.03577727154783781 | 0.059033504147481236 | 0.010175355724821391 | 0.014566405588524348 | 0.033956109335233166 | 0.012383718546096096 | 0.03259071417984969 | 0.0034565037668517293 | -0.07417027323830008 | 0.01766136027348414 | 0.018363081642010563 | 0.027060905997497074 | -0.07203022705576063 | -0.009456473397110128 | -7.774880728379369E-4 | -0.0516472364776821 | -0.06279595541846714 | 0.04477162227344661 | -0.11741666761780052 | 0.20173724524712836 | |
| 138.98 | Acetyl phosphate [-H(+)] | cpd:C00227 | -0.09619725854108178 | -0.10063887488292136 | -0.028804139024749056 | -0.1286759971162915 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 139.975 | Carbamoyl phosphate [-H(+)] | cpd:C00169 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -0.034087436513994256 | -0.08919745025434078 | 0.02311494731645373 | 0.04372383857377108 | -0.011947011315877724 | 0.08534550096726409 | 0.06139785722071139 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.032129705044095645 | -0.030105680764393804 | -0.06194054333472401 | 0.025532659402877727 | 0.016764878418274835 | 0.02219833255637629 | 0.039844965183048225 | -0.03444851972839645 | 0.03516986095816871 | -0.08352356154193791 | -0.02926375245594139 | 0.006247228969125183 | -0.025106643898209328 | 0.3628776224030005 | |
| 145.041 | Thymine [+F(-)] | cpd:C00178 | 0 | 0 | 0 | 0 | 0.0024119776661148174 | 0.06114076797298572 | -0.15200091800495594 | -0.07075294975218555 | -0.0318927554510355 | -0.019967060565591374 | 0.05488457439227621 | -0.018958795695257227 | -0.012340239287213391 | 0.05125186559240682 | 0.11476118015363987 | 0.04376576743679679 | 0.013802261334629891 | -0.0662050534425942 | -0.17281136840232744 | -0.08619888939267661 | 0.0099128315502061 | 0.10196842796715098 | 0.04366328414395879 | 0.03669425890630191 | 0.056861201050489675 | 0.00700725524447458 | 0.02674710473432213 | 0.0436919494092246 | -0.06069905897354558 | -0.004933685643075518 | 0.001361913257337196 | 0.03190399260929731 | -0.12404615498486342 | 0.0066379510045653 | -0.004426990825987324 | -0.04237108410853659 | -0.08043090015147528 | 0.05010265907312805 | -0.10788361608392055 | 0.18520523835795463 | |
| 145.062 | L-Glutamine [-H(+)] | cpd:C00064 | 0.0481276829788051 | 0.16960418224508822 | 0.16629311930292937 | 0.09146752018479005 | 0.011354120342790097 | -0.03898011143558781 | 0.01920371825852314 | -0.06895395812582056 | 0.07154480483457419 | -0.06529755114547314 | -0.01905208813897176 | 0.035167309022664545 | -0.06221955078394777 | -4.865665685901148E-4 | 0.3382741539865364 | 0.09870828331173623 | -0.11858534653953809 | -0.09279889379814239 | -0.03084588424890579 | -0.053015910932959195 | -0.003712968888786868 | -0.071362792638711 | -0.02062450174322976 | 0.03130612727597587 | 0.019822080435293193 | 0.020679562350152194 | -0.044480947917397325 | 0.08872008284957233 | -0.012049345738670919 | -0.03828911003986559 | -0.006959339537694012 | -0.08906324605579216 | 0.047912105239176904 | 0.022048857509806716 | 0.10535137495415137 | 0.06761583874055294 | 0.02820475116036273 | 0.00593928271040171 | 0.03636842747553356 | -0.24676535141594014 | |
| 145.098 | L-Lysine [-H(+)] | cpd:C00047 | 0.5647494890722594 | 0.5815275524068888 | 0.5759280593536467 | 0.41459393692458685 | 0.005140097693206678 | -0.014924460472546808 | -0.03351785452152692 | -5.922812239312447E-4 | 0.13689970455154005 | 0.03454676131779152 | -0.05635941777118657 | 0.04616735531362388 | -0.04058728422774144 | -0.023938119228453143 | 0.020901471368270013 | 0.022729155655743672 | -0.0107521249801396 | -0.045180043649366106 | -0.003443331504618438 | -0.010319322755846945 | -0.005661170847870194 | -0.02111582925039181 | 6.916050309158854E-4 | 0.016117865182935138 | -3.2418220200639903E-4 | -0.004372356573986577 | 0.1340304541568717 | 0.061193087179308776 | 0.04247420679400363 | 0.07294452292126814 | -0.04161616141483098 | -0.008312149193084498 | 0.04625720130849443 | -0.08481752940955159 | 0.019048835963540806 | 0.04537875749762391 | -0.03250647938082044 | -0.01090114122996831 | -0.05291747358904354 | -0.3749872721982108 | |
| 146.046 | L-Glutamate [-H(+)] | cpd:C00025 | 0.15519996943894765 | -0.008866051479880519 | 0.06581419817011289 | 0.05511094664213781 | -0.00613933609228159 | 0.0742597507829606 | -0.07810604694184255 | 0.030378317520203837 | -0.043364036075271596 | -0.034209971692774 | -0.02850203287623247 | -0.10756178165543283 | 0.05150255129977411 | -0.07047114937710647 | 0.01889462630814781 | -0.010263041836318019 | 0.004958040385630973 | -0.050405136863166354 | -0.014925341091411755 | -0.05001262124499619 | 0.04162611848479996 | 0.045139202761688625 | 0.041934639429128784 | 0.001228642917850204 | 0.06041814988317092 | -0.013851744897944286 | -0.07414181354993161 | -0.05385042417473947 | 0.038010709150272506 | 0.01368308604246008 | -0.0034605707069632775 | 0.048826859018314565 | 0.06069413327674056 | -0.026359606884942266 | 0.025325253309842585 | -0.031032928764778776 | -0.10191169515347892 | -0.015386134170995013 | -0.02863300506606986 | -0.17764133774873098 | |
| 148.043 | L-Methionine [-H(+)] | cpd:C00073 | -0.035955437486518846 | -0.018178786515133737 | -0.002440978638021315 | 4.210290262268637E-4 | 0.006973813390774312 | -0.04038785721820448 | 0.015617388990774379 | -0.01578567806638436 | -0.01056478868191719 | 0.00633408514212881 | 0.03651822780375983 | -0.011023218955820398 | 0.058504205045942635 | -0.0025468532539625363 | -7.234186958922252E-5 | 0.013526164879795795 | -0.02516374821982429 | -0.06906798172303819 | 0.03193625805316526 | -0.6810103015614315 | -0.011897103337071176 | -0.023675684206429123 | -0.004713924854728493 | 0.007788314822970233 | -0.0021485375589501967 | -0.006484829060027839 | 0.019883626720835372 | -0.03906199310250646 | -0.035753906970965595 | 0.025044739982061925 | 0.044246201829310966 | 0.06450147306896545 | -0.02577992374813463 | 0.031533478745262675 | -0.007586954528761981 | -0.04621893852040581 | 0.017262917950998585 | 0.016277486092484243 | -0.10656709816169407 | -0.008129855265928214 | |
| 149.046 | D-Ribose [-H(+)] | cpd:C00121 | -0.03331559113853295 | -0.01876978275136286 | -0.055365729787841746 | -0.18213080960254233 | -0.008187636253759031 | -0.08307944240627547 | 0.07092637780637442 | 0.03791826230441299 | -0.12616964545250656 | 0.07395792970809419 | -0.035135551149697554 | -0.09448600939737418 | 0.1529923321128911 | -0.0011284314979636966 | -0.022483020771698413 | 0.10775431771131375 | -0.2031315814224476 | 0.008195256193228605 | -0.14725259516726552 | -0.06463010251548289 | 0.11105624974210093 | 0.05312696070723953 | 0.09605467863062671 | 0.09096986637778746 | 0.10684878778743154 | 0.10604091637863648 | 0.0854435439452657 | -0.20104860598821858 | -0.1445076338367168 | 0.10656922950143684 | 0.18225686593390872 | 0.28509399697706894 | -0.06894555088166257 | 0.14760973066892025 | -0.06551948784529642 | -0.25643156409573276 | 0.07682800274495895 | 0.05908644655771034 | -0.4950681095210141 | -0.021222806487478263 | |
| 150.042 | Guanine [-H(+)] | cpd:C00242 | 0.01500869033417169 | -0.03181401661406241 | -0.07399515861439147 | -0.19549634656932696 | -0.01900781806540473 | -0.06439337722464386 | 0.07726284288994108 | -0.011383438149756625 | -0.03349603621504574 | 0.021955138355736464 | -0.009607069930017482 | -0.038924834702370195 | 0.04039576230753496 | -0.008247323391729861 | -0.035787895027708766 | 0.01833701110617085 | -0.09890397359244629 | -0.05647571394921974 | -0.04775415096504591 | -0.12643519595668787 | 0.009200588346711338 | -0.03057175200235315 | 0.008782493460601802 | 0.011283610746016567 | 0.03747570480979113 | 0.0045959915507110625 | 0.02115690478924977 | -0.039964241203649525 | -0.025120993883416005 | 0.03405726607174412 | 0.0037567337134970288 | 0.0030018760248917025 | 0.015582608549517884 | -0.026023839788268176 | 0.0040495929577325064 | -0.03196043924017673 | 0.008306087593924505 | 0.008865142668265416 | -0.04812306269390215 | 0.019397175853002612 | |
| 151.051 | L-Asparagine [+F(-)] | cpd:C00152 | 0 | 0 | 0 | 0 | 0.027043745096093533 | 0.033223867651316734 | -0.11546430662496134 | -0.07991258716951954 | -0.056455438176609744 | 0.005859065037265501 | 0.07892265641785247 | 1.2805598341676582E-4 | -0.022363141236577004 | 0.040411608497779014 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.03928453584438227 | 0.031201966467334183 | -0.0451768892342432 | 0.017224615876642917 | -0.01472622014027812 | -0.0017003550965038134 | -0.06750917352808883 | -0.026168693491581813 | -0.014804280893169467 | -0.01772396690485889 | -0.02594680591701769 | 0.05013158126547475 | -0.08064821471388312 | 0.09415808902077613 | |
| 151.087 | L-Ornithine [+F(-)] | cpd:C00077 | 0 | 0 | 0 | 0 | 0.06444173683135067 | 0.019941954886611338 | -0.07430680396121477 | -0.0674382322640022 | -0.0019150717803201886 | -0.04502677066024405 | 0.02164850875075138 | 0.02971871341254901 | -0.06139050074013491 | 0.0011379133745493821 | 0.030215381379039764 | 0.048756709086129814 | -0.1390495588313127 | -0.15320733443186282 | -0.22758210699291595 | -0.15470631709338953 | 0.062011834301667165 | 0.017634388587758495 | 0.06502605093562407 | 0.05400831028817145 | 0.09578673547307558 | 0.06790844693792855 | 0.1365592062688605 | 0.0923611770767968 | 0.024415337081980598 | 0.04112953627059662 | -0.02672680750025065 | -0.06030962518845478 | -0.044470956325332996 | -0.13316510365786258 | -0.012189425780528826 | 0.008536451750640649 | -0.0032039113669216214 | 0.04977482297603988 | -0.13577593112820963 | -0.1395905661462716 | |
| 152.036 | L-Aspartate [+F(-)] | cpd:C00049 | 0 | 0 | 0 | 0 | -0.008330720535017199 | -0.02726706985348611 | -0.007483584210456126 | -0.046286158816386244 | -0.05186859349591597 | 0.028153489820705892 | 0.022515755500352234 | -0.022026887171110666 | 0.04228849912219085 | 0.059389917882365105 | 0.004505098087468969 | 0.034708850411544694 | -0.09293172845205575 | -0.024102026545241788 | -0.15213784491882842 | 0.22466653172603626 | 0.03293962810814512 | 0.006720745977807189 | 0.009975779553977306 | 0.051484760862675054 | 0.02136646727787791 | 0.014763382487683229 | 0.03226839471966458 | -0.11237876385613148 | -0.11573585206146375 | 0.04052423913521473 | 0.1022320196504608 | 0.15867843048688388 | -0.072986902454763 | 0.0649917921552247 | -0.032174061652008645 | -0.14561133827100478 | 8.74959670616565E-4 | 0.029914935718189203 | -0.24337471798682483 | 0.1019630052027428 | |
| 154.033 | L-Homocysteine [+F(-)] | cpd:C00155 | 0 | 0 | 0 | 0 | 0.04086080673688615 | 0.06508310954636747 | -0.04944140643015471 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -0.04245340677414185 | 0.04803496067998826 | -0.07085066063402533 | -0.02378723053264487 | 0.008648845072993181 | 0.03451016715592374 | 0.006266560791377732 | 0.02219496769873872 | 0.04313370197879495 | -0.051720300281192934 | 0.0330920953912637 | -0.014178180023450953 | -0.12260112845754216 | 0.031903964254267184 | |
| 154.052 | Adenine [+F(-)] | cpd:C00147 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -0.03863015766507292 | -0.003635416286404791 | 0.0037653094294091667 | -0.003480669565513157 | -0.01526312293259485 | 0.03858076138745956 | 0.02868429177242123 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.030321726108233183 | -0.19789838613435104 | -0.17377545056133906 | 0.054208983402427705 | 0.09812067125093289 | 0.16626097811093848 | -0.14969404972362413 | 0.1306312617177343 | -0.10339726077736193 | -0.21767597641938538 | -0.0568068010952434 | -0.010086268791457277 | -0.28763087053132835 | -0.004373764753342599 | |
| 154.058 | L-Histidine [-H(+)] | cpd:C00135 | 0.48180743238237306 | 0.36550536488851515 | 0.3649877998330481 | 0.21543334838849826 | -0.008997942489974122 | -0.023420984630909764 | 0.057658815996838274 | -0.006568724570764836 | 0.07729540490104832 | -0.052439543207377426 | -0.06522760573950116 | 0.00653483407108651 | -0.014252551196729541 | -0.05675991690188123 | 0.012871130386245539 | 0.017905792676544036 | -0.0428618602074948 | -0.07074632642383699 | -0.02173507523980585 | -0.01045096774384008 | 0.0028687210153142567 | -0.013313023166334523 | 0.0050498770638669884 | 0.005104355891249177 | -0.009425923085967866 | -0.006998750799960955 | -0.011126937421020076 | -0.02331288984476229 | -0.003721645383220427 | -0.006152666534488081 | 0.004147095233710718 | -0.010448837300475801 | 0.05063718855594726 | -0.025178837026939727 | 0.04345176050377081 | 0.004998232520774922 | -0.04126410308206734 | -0.005337974165450975 | 0.013449478936551488 | -0.19306805383109482 | |
| 159.977 | Carbamoyl phosphate [+F(-)] | cpd:C00169 | 0 | 0 | 0 | 0 | 0.002813311689747479 | -0.08155454252591383 | 0.12943516077512904 | 0.20370971178874708 | 0.09390848089906582 | 0.26711853387863616 | -0.09566024066035853 | 0.10936699352717268 | 0.26381435086148913 | -0.08333732431535718 | 0.07093975783063149 | -0.07049451293485455 | -0.011434417079317043 | -0.08814398635883193 | -0.20466445502144404 | 0.2154505847702906 | 0.07567030753945893 | 0.05453106068854198 | 0.024374168553350437 | 0.00767474954435326 | -0.028665398144775308 | -0.025596550464888877 | 0.007930498167865101 | 0.008278948333789187 | -0.14535693748919384 | -0.007905677812159487 | 0.023839378837416617 | 0.00543163703785446 | 0.051505594589327144 | 0.028644806607625948 | 0.08455826391686719 | -0.09265346332800439 | 0.03685688464137799 | 0.00501503413606837 | -0.030328846888005304 | 0.211427410792009 | |
| 164.072 | L-Phenylalanine [-H(+)] | cpd:C00079 | -0.07005611420878576 | -0.006137149904911979 | -0.051094158780926276 | -0.0664263844249731 | 0.003655836609631743 | -0.04634706277650712 | 0.025642506575873372 | -0.00639973004478692 | 0.01901715574576302 | -0.009837306998607328 | -0.031203085489231442 | 0.0116416859511918 | -0.0016721650683150997 | -0.022862929439640484 | 0.0010974844357160899 | 0.022501961321764935 | -0.01265957721064624 | -0.04461300332503722 | -0.03317555492876406 | -0.010288205357055076 | 0.006250837282978625 | -0.01632154308409939 | -7.893716654433341E-4 | 0.013137713337751277 | 0.0036592896110788434 | 0.01272744316982468 | 0.04601768333448889 | -0.0021556225811386834 | 0.03647927545210358 | 0.007213302445328449 | 0.007614505823715005 | 0.009129098044148272 | 0.01995184734912188 | -0.011552671239664917 | 0.010399315005155469 | 0.022410328470124714 | -0.009214550674890491 | -0.013002150482702503 | 0.003925425500536034 | -0.060904545381010554 | |
| 165.067 | L-Glutamine [+F(-)] | cpd:C00064 | 0 | 0 | 0 | 0 | 0.03691910035051356 | 0.01600086083343455 | -0.0641512645241497 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.009953052883163921 | 0.03213846100117874 | -0.05790882662000673 | 0.009146416220590285 | 0.0022924647276012415 | 0.0020983625591562234 | -0.05767094206551448 | 0.046276595858332485 | -0.0024276189355101397 | -0.06486153180399387 | 0.10323395537106536 | 0.04113531154979975 | -0.09973460311692822 | 0.0638249995503399 | |
| 165.104 | L-Lysine [+F(-)] | cpd:C00047 | 0 | 0 | 0 | 0 | 0.05809159333420081 | 0.01560733044885129 | -0.06757033718452565 | -0.07980317444057781 | -0.009502931563919154 | -0.04237819193792998 | 0.01131442659714632 | 0.03225887178626523 | -0.053472227914623784 | -0.0210728024783406 | 0.017202608819182428 | 0.05484309547665736 | -0.1417665041737311 | -0.1090732698519586 | -0.22509997395291703 | -0.13154898319621602 | 0.037264916963487195 | -0.0031390745381409415 | 0.04740081616366437 | 0.03488805531352728 | 0.09411432071802751 | 0.01485788432652041 | 0.16463306682707612 | 0.09962975496043103 | 0.0176048707560849 | 0.054292669498801974 | -0.027392390700772134 | -0.03977201068554992 | -0.008125407461927468 | -0.1681633744297987 | -0.01364788226624678 | 0.01620545373699339 | -0.00828764382442499 | 0.04969859953531344 | -0.16731461431317884 | -0.20478580459158627 | |
| 166.052 | Pyridoxal [-H(+)] | cpd:C00250 | -0.2013560581710408 | -0.13401060770219758 | -0.15160766558824534 | -0.1781594080948493 | 0.003715671113942729 | -1.2626959628920335E-4 | -0.06846283829052956 | -0.018930950594033196 | -0.03780245603431327 | 0.0480578871816998 | 0.027115058879293042 | -6.383413754853285E-4 | 0.07663769244570895 | 0.05963490624982585 | 0.5452716922197532 | 0.09905580106142302 | -0.056482194306295454 | -0.01791694808298311 | -0.07944700311882083 | 0.00453724968563587 | 0.03502947570382754 | 0.05543241801655353 | 0.011653230715871836 | 0.02899077013329462 | 0.008881843973138404 | 0.016448192157017896 | 0.03387960766369781 | -0.1098664600872334 | -0.10384936848821838 | 0.041028946593573035 | 0.07775727600464502 | 0.11147353003966344 | -0.09802703748110889 | 0.04328004726273331 | -0.03295569868697818 | -0.14011652232956257 | 0.005987330471411925 | 0.025330134064716844 | -0.28925478883415545 | 0.03681730609074059 | |
| 168.054 | L-Methionine [+F(-)] | cpd:C00073 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -0.05161134145412861 | -0.048996740915219536 | -0.019926002030176786 | 0.010009211363637995 | -0.013580534622852603 | -0.009175511036494848 | 0.04555887751698326 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 168.991 | Glycerone phosphate [-H(+)] | cpd:C00111 | -0.04023729033654898 | -0.2179281321482288 | -0.07824760070163375 | -0.02308810162045136 | -0.014136097986292503 | 0.08120983879190896 | -0.0505637884533156 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 169.05 | D-Ribose [+F(-)] | cpd:C00121 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.019410408933435826 | 0.0891751832278299 | -0.10511834531090508 | -0.015425548226063497 | 5.329454065598542E-4 | 0.016510339970876527 | -0.08917562333927043 | -0.01829418918440103 | 0.0017407462215344397 | -0.05471916552336115 | -0.048635649769645996 | 0.053497457417211784 | -0.13205003545791064 | 0.22203165601124225 | |
| 170.045 | Guanine [+F(-)] | cpd:C00242 | 0 | 0 | 0 | 0 | 0.007790110617923131 | -0.01902586809011866 | 0.011867640399190239 | 0.005691702533755235 | -0.02201666844978621 | 0.015480200933255247 | 0.016127810354023178 | -2.126847212532664E-4 | 0.018503605384493096 | 0.01819439442003011 | -0.01942451983241566 | -0.007596833162365383 | -0.06561429909817507 | 0.12792868451401654 | 0.0675294758464893 | 0.10771664571686995 | -0.08515706956429497 | 0.005147424406015549 | 0.008679057142041192 | 0.02915198485348459 | -0.030300250227608468 | 9.749004178184067E-5 | 0.023711937193718235 | -0.046711723759652476 | -0.015771183835121997 | 0.018132995166814315 | 0.041615816514873095 | 0.04059403100979818 | -0.03617313297838631 | 0.03354129278016558 | 0.017177850923936044 | -0.039717528911269874 | -0.026107740622578212 | 9.89984103905009E-5 | -0.12970825365143462 | 0.07459359322514149 | |
| 171.007 | sn-Glycerol 3-phosphate [-H(+)] | cpd:C00093 | 0.06359636036384538 | -0.09083352319940548 | -0.22433273692467204 | -0.36503870270379574 | 0.14344104006289946 | -0.1687885256223361 | 0.01768815410284165 | -0.05244673487968935 | 0.006016039769621364 | 0.03603912192346926 | 0.6606874384502732 | 0.008505114420264855 | 0.060978639080745106 | 0.009719317345172541 | -0.02453393521831903 | 0.03362144236990435 | -0.20409127593593354 | 0.14923041238387333 | 0.5716794383400564 | -0.09709184394271449 | 0.06517033386974302 | -0.04515905618140819 | -0.09863425388479927 | -0.002455593878524256 | 0.024878601445176923 | -0.02842281575293707 | 0.18914954629508093 | 0.25000753447926993 | -0.10381037718542706 | -0.1326885575036439 | -0.018484995159222764 | 0.04645039028869433 | -0.23700673172180722 | 3.28920131434811E-4 | 0.05214077685990157 | 0.6125503282608017 | -0.035142170184333264 | 0.06334255233987372 | -0.002745865046369927 | -0.188055618415147 | |
| 173.105 | L-Arginine [-H(+)] | cpd:C00062 | 0.44698660026498244 | 0.48723919080958744 | 0.4910456648574617 | 0.3307646625387014 | 0.0027935411157931694 | -0.026398488912992124 | -0.01805826333329652 | -0.011009939277751684 | 0.07035337570229427 | 0.020097833909295884 | -0.052107128122192224 | 0.03491247831630493 | -0.0616701399182435 | -0.008165576576691928 | 0.03555370462688609 | 0.033842026604877944 | -0.01655428932993128 | -0.07382611279561382 | -0.07227583729829806 | -0.010637500313723887 | 0.056316254857451044 | 0.04073218006829455 | -0.011690314602078552 | 0.011578826556768665 | 0.009045595720356906 | -0.010676713733078269 | 0.1550894775991416 | 0.056116147983559156 | 0.03076666910112757 | 0.07794971573690732 | -0.03755833870987223 | 0.0020218724736229157 | 0.039096016600100154 | -0.08758361219595867 | 0.02423829472245347 | 0.04727175785253411 | -0.05231979537378591 | 0.002090086276879807 | -0.07426816792579234 | -0.33328075902065424 | |
| 174.067 | L-Histidine [+F(-)] | cpd:C00135 | 0 | 0 | 0 | 0 | 0.04427253694142829 | 0.039905966294799866 | -0.08280137408431575 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.03919848086207306 | 0.05154933188142398 | -0.04388957863969351 | 0.015133490673999083 | 3.0712393468679944E-4 | -0.025833913361624484 | -0.04265019737084342 | -0.043653512767424706 | -0.011931229540087983 | -0.011478605619943289 | -0.02271250414113482 | 0.07115250014356285 | -0.04146612730134234 | 0.07322006946702851 | |
| 174.089 | L-Citrulline [-H(+)] | cpd:C00327 | -0.08122512439076254 | 0.022874515801623894 | 0.11454753974929609 | 0.10209690969605456 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.02087388033253399 | 0.003511433276900845 | -0.022208956329433996 | 0.008829103507568183 | -0.007111963120516573 | -0.04599555991504136 | 0.0015824267223366185 | -0.0314801142871069 | 0.05333557843667876 | 0.0012769746067069862 | -0.00638613411656439 | 0.0032851371577143416 | -0.058291322609244425 | -0.025782046211274216 | |
| 175.026 | Ascorbate [-H(+)] | cpd:C00072 | 0 | 0 | 0 | 0 | 0.028864627814768316 | -0.04353320145436232 | 0.0028778279429640887 | -0.028211065727978688 | -0.02309278215327164 | 0.026927385181111034 | 0.0895231695125172 | 0.018972701950671068 | -0.010465099667968424 | 0.12528695870604944 | -0.014772119340370099 | 0.0933747196568965 | -0.1849217601809883 | -0.025930710690367786 | -0.22166238392647092 | 0.4315775439209339 | 0.10812634612199083 | 0.07116581304163304 | -0.023200487492540226 | 0.03300298407434166 | 0.05341677605535346 | -0.04327029854570761 | -0.10124245393754294 | 0.14054640635099044 | -0.15446354342688629 | -0.032606077296729465 | 0.1070351175322308 | 0.08041925326307954 | 0.06938681138718147 | 0.06655783386237603 | 0.1771284895924111 | -0.10916204320376313 | 0.23138490261679986 | 0.07592210954590235 | -0.08365191484041183 | 0.18029755504890055 | |
| 176.936 | Diphosphate [-H(+)] | cpd:C00013 | -0.6533730405037753 | -0.5485037852152163 | -0.4686197559361231 | -0.31427578368949916 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 179.056 | D-Glucose [-H(+)] | cpd:C00031 | 0.21702350350486557 | 0.2420973960709653 | 0.18275717000266314 | 0.0391103260621989 | 0.0015036336879629398 | -0.08491961041991966 | 0.08546747732808373 | 0.04461963027987174 | -0.013473846717866554 | -0.012732553437015804 | -0.012937265694104015 | -0.0017062487492665362 | 0.06238848128129273 | -0.011535108005691222 | 0.04750021059454178 | 0.024661348946875647 | -0.21826555194523498 | -0.1250151455652965 | -0.1225464481393773 | -0.017565909347976905 | 0.07027986359123399 | 0.013598102754402255 | 0.007917486931694192 | 0.02154242060999444 | 0.03346701801924448 | 1.4974102389789666E-4 | 0.02680131816356918 | 0.12159340767277363 | -0.0710213034475472 | -0.015600406273280553 | 0.05972275653983304 | 0.11047895885067033 | 0.028095872626179377 | -0.012798569449185785 | 0.11216852044593482 | -0.07138182078546089 | 0.04643225987743651 | 0.08623207086820266 | -0.38962943276448625 | -0.1130906050803481 | |
| 180.067 | L-Tyrosine [-H(+)] | cpd:C00082 | -0.1185422608258624 | -0.0649060417790993 | -0.05442366430134893 | -0.08355499705692544 | -0.0011867531933631929 | -0.035598974125280194 | 0.00747535109265558 | 0.0031031598409949433 | 0.010674048743874532 | -0.0010226661364865948 | -0.004920917233571332 | -0.021165122301298123 | 0.039970950455937834 | -0.05800460171739707 | -0.0031098725832160528 | 0.019918081025493237 | -0.007833168870640369 | -0.06661900036148943 | -0.0596648095437818 | -0.026852967372212946 | 0.02014363861111071 | -3.3365870833661573E-4 | -0.007311248192163346 | 0.009954383089516287 | 0.02217408653772559 | -0.005963947438600931 | 0.05763571804801143 | -0.0024583483027937987 | 0.044356400637254295 | 0.01624828391549661 | 2.030551017364308E-4 | 0.02495770508099059 | 0.005631451883747519 | -0.02704600589895837 | -0.005918741876419365 | 0.022581409904220133 | -0.05416247931954581 | -0.01932620988020588 | -0.02717339289425821 | -0.05731071311962066 | |
| 181.07 | Mannitol [-H(+)] | cpd:C00392 | -0.12469362390782421 | -0.06928284864656249 | -0.06629742496213087 | -0.10296607212440924 | 0.021033720836757697 | -0.013321477911849358 | 0.005044828922337445 | -0.02753031052881564 | 0.0012840043396617478 | 0.010762549570289897 | 0.010784376969604848 | -0.02023383724649395 | 0.01618387417216819 | -0.023028300714669808 | -0.016319051844092096 | -0.021161874056902792 | -0.04530038835332997 | -0.11287147518555357 | -0.046530586370327365 | -0.001657739212788903 | 0.013439514823780474 | -0.00661189338382483 | -0.0322239233893256 | -0.028886444232092755 | -0.01841711684994742 | -0.029289616136329456 | 0.05630362358051611 | -0.004596278655521748 | -0.014507193805668445 | 0.015414435682624563 | -0.0027702123878817083 | 0.0224730220952478 | 0.006484176456500763 | -0.029551562547376013 | 0.006583603282585451 | -0.01260790109839577 | -0.03227981500676251 | 0.00234314795475114 | -0.042822760510690304 | 0.07450265854194221 | |
| 183.067 | Choline phosphate [-H(+)] | cpd:C00588 | -0.16270642586951595 | -0.02643045817900366 | -0.03632654709095331 | -0.059315880616053154 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.04023595410396654 | 0.08882564963031528 | -0.08155614499489623 | -0.026807787096277375 | 0.006910472172316477 | 0.01037555594519142 | -0.08136070402512441 | -0.022536560177193635 | -0.007058714393761131 | -0.06258906186303574 | -0.0319428975704966 | 0.08048470961976038 | -0.11515147615274661 | 0.21080430044769902 | |
| 184.073 | L-Phenylalanine [+F(-)] | cpd:C00079 | 0 | 0 | 0 | 0 | 0.05280906635780744 | 0.04105574671037384 | -0.11498765835483306 | -0.09084836062154669 | 0.025436093299825477 | -0.050486938969165354 | 4.915020806456427E-4 | 0.03629534241405553 | -0.03202631832184366 | -0.018762464404837077 | 0.04676002113189098 | 0.053938135803856035 | -0.08557353557356903 | -0.06408862934802582 | -0.12133343555547613 | -0.015361859764620124 | 0.019985030727232983 | -0.023517214109135036 | 0.004599471116275751 | 0.048314433948314854 | 0.05480280210558991 | 0.04299260309464163 | 0.09347669272357352 | 0.06306799021695192 | 0.023464779568769027 | 0.04284021560947126 | -0.025718503606281088 | -0.04223629797418974 | -0.01984070580753276 | -0.09067341928290606 | -0.0018501213216205953 | 0.007489678635896411 | 0.017517383618466022 | 0.036549213538029125 | -0.08891433020975335 | -0.12069568043827114 | |
| 184.988 | 3-Phospho-D-glycerate [-H(+)] | cpd:C00197 | 0.0841119145912513 | 0.11916205801702064 | 0.13500814700997024 | -0.10321555444701351 | 0.07296198457272206 | 0.01203991401059025 | -0.12260450598106412 | -0.04739631345878428 | -0.04740117223579152 | 0.040876242948975905 | -0.12743702005622454 | -0.08976641816751252 | 0.005715783777406293 | -8.617614827376909E-5 | 0.3647764252772599 | 0.09155429175929107 | 0.12553212150990573 | -0.08536064108065178 | -0.14922579220682414 | -0.08567297471568998 | 0.10087713574198581 | 0.2534052430857636 | 0.08653386264401332 | 0.04093857418412507 | 0.038272464468162626 | -0.04905163548812592 | -0.02783689796758113 | -0.0075909910670841334 | -0.06574220580767265 | -0.027338145423930083 | 0.0468688204737892 | 0.07911798726130896 | -0.014887877871592752 | -0.009014909181342408 | 0.06068520582382166 | -0.057415235540584426 | -0.06478857452456105 | 0.05477651238722038 | -0.2265913588000932 | 0.24584509329713694 | |
| 186.058 | Pyridoxal [+F(-)] | cpd:C00250 | 0 | 0 | 0 | 0 | 0.03249481799398655 | 0.020311494783746966 | -0.05378268666410983 | -0.07090062671085709 | -0.01571106446797296 | 0.007025825852588993 | 0.033533345328864456 | -0.010094470886918026 | 0.017022732262446723 | 0.015341508919194549 | 0.04789420292580448 | 0.03687346579840806 | -0.0764017437359024 | -0.044346625044083675 | -0.07224979404419338 | 0.0061643620575508404 | 0.061771281877841595 | 0.020776772594289755 | 0.018594542307678198 | 0.0379957481540587 | 0.03789179338945031 | 0.02162423547489732 | 0.06855119948171678 | 0.021653969411284096 | -0.023255853995561477 | 0.036298230927807706 | 0.015241895298901527 | 0.0030057180439885395 | -0.01522473468631705 | -0.03256276614529888 | 0.007343647139802974 | -0.036203736820011635 | 0.004515868296128127 | 0.045993966584299925 | -0.09966990325654768 | 0.051341718481294873 | |
| 193.108 | L-Arginine [+F(-)] | cpd:C00062 | 0 | 0 | 0 | 0 | 0.014365640248244242 | 0.026749790151695162 | -0.07544908741285888 | -0.04850897288944427 | -0.0405938852808525 | 0.0059523804086659814 | 0.02615092790984129 | -0.0035551947606569452 | -0.005902989917793001 | 0.018123449624168196 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -0.1036322837653785 | 0.24805581555017978 | -0.06200987896487469 | -0.01104010604441335 | -0.00751433474490017 | 0.03607058283515142 | -0.017784684905410006 | 0.14209001053298212 | 0.08508056507935506 | -0.1192969250399872 | 0.4069868452799511 | 0.1608342776274514 | -0.11933845606611927 | 0.23392144391249292 | |
| 194.094 | L-Citrulline [+F(-)] | cpd:C00327 | 0 | 0 | 0 | 0 | 0.0509333766890106 | 0.04400272965036145 | -0.11134990945510509 | -0.10355041927625232 | -0.021670300171612682 | -0.030739337682535884 | 0.028326180050816004 | 0.008465336432214397 | -0.028585888888098772 | -0.021906815246273675 | 0.056409144287069175 | 0.05671428968062202 | -0.0841120242731124 | -0.09129750065892617 | -0.10996697322388678 | -0.11427377576669438 | -0.013612766094842967 | -0.018171305199577752 | 0.045267719251773676 | 0.056856400980392754 | 0.0706307386519898 | 0.05866690610514471 | 0.1095510883626645 | 0.07699760947030045 | 0.007906892674465359 | 0.04965519119520005 | -0.027865572112213008 | -0.02130829778280279 | -0.04045694924021769 | -0.07905115366040218 | -0.007606502371175961 | 0.016686459252785727 | -0.005454950914060908 | 0.04388113196259162 | -0.09919057859190261 | -0.07618379127222802 | |
| 195.029 | Ascorbate [+F(-)] | cpd:C00072 | 0 | 0 | 0 | 0 | 0.019434970293044477 | -0.008198753676719345 | 8.478695526571555E-4 | -0.0324030783597065 | -0.03549208506680538 | 0.0196917905053364 | 0.024481997441813827 | -0.017076308603628576 | 0.017384894826598777 | 0.038551214746493014 | 0.025412757562378416 | -0.023464699579289983 | -0.15330681362213514 | -0.09501108249355636 | -0.19458902764805658 | 0.022799209977726283 | 0.07516098978121874 | 0.08463774425133792 | 0.03185684257191532 | 0.04049893472726185 | 0.025689884790380455 | -0.010819398772227769 | -0.036370032642599213 | 0.04691633685725047 | -0.06703402143448924 | -0.04184336774637109 | 0.07312992684736419 | 0.11905324207767663 | -0.01893427515615821 | 0.0183745452727 | 0.05102677215941314 | -0.07068619651506876 | 0.10158229002232518 | 0.0618449672156824 | -0.29109441823604465 | 0.1681228688662981 | |
| 199.002 | D-Erythrose 4-phosphate [-H(+)] | cpd:C00279 | -0.37293787261034816 | -0.21749193210441758 | -0.1418956507105587 | 0.10688305057724064 | -0.0157628400240754 | -0.055640369987524495 | 0.01916269934065981 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 199.062 | D-Glucose [+F(-)] | cpd:C00031 | 0 | 0 | 0 | 0 | -0.0032560016161743434 | 0.10734679535425067 | -0.30443778034503705 | -0.12782476861200837 | -0.10535266140727975 | -0.017206901517618937 | 0.08589695905596566 | -0.024046281711974073 | -0.009200991779418879 | 0.08677756915718411 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.04540760031031209 | 0.14987326548083807 | -0.11609832835137467 | -0.03395110918756005 | -0.018224330062730165 | 0.022005436209382122 | -0.2053904636832726 | -0.051695657600263636 | -0.08170662607740857 | -0.029523667536662978 | -0.14832729331409805 | 0.08523859041917428 | -0.17589371365999848 | 0.28928752579543576 | |
| 200.074 | L-Tyrosine [+F(-)] | cpd:C00082 | 0 | 0 | 0 | 0 | 0.03500657791484951 | 0.011750534639048155 | -0.046541112087583256 | -0.030243869146826523 | -0.010238935554367213 | -0.021008658472797807 | 0.0391302416153479 | 0.02291396580195176 | 0.015734576444080755 | 0.004389454071574356 | 0.01975106486662221 | 0.05311941756834487 | -0.09289138864669301 | -0.0025857745803986123 | -0.09111608551025444 | 0.07544408971462306 | 0.03286286847528343 | 0.008347029302014917 | -0.02099250669072589 | 0.01478090189502382 | 0.02554027652853632 | 0.023948627563889303 | 0.056306208616071836 | 0.05990977798437787 | -0.006096869304989366 | 0.006113055169183831 | -0.022444102867372865 | 0.015310864913231937 | -0.03557286948154183 | -0.061263661011678246 | -0.006955505875871826 | -0.03819420441040728 | 0.08575258480995157 | 0.04459703565191059 | -0.12974613243925004 | 0.0345495821792835 | |
| 201.078 | Mannitol [+F(-)] | cpd:C00392 | 0 | 0 | 0 | 0 | 0.06473080653162587 | 0.019110358634331776 | -0.06566670352949622 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.05438752405711179 | 0.0319269835010075 | -0.08186108760814896 | -0.06910339425136845 | -0.18238541885492776 | -0.035581604105840735 | 0.06911427753165426 | 0.0612126086482538 | 0.013691127574693577 | 0.046247510896429735 | 0.09901159890942837 | 0.049803650694771814 | 0.07396362052549346 | 0.1039743401059526 | -0.02596728896081422 | 0.022989943180029778 | 0.005332328510832323 | -0.010480267082875442 | -0.031407271643653964 | -0.07078013779641144 | 0.011982174625449503 | -0.05324441703255744 | 0.06150657601151317 | 0.0485009694320747 | -0.10753434500638624 | 0.007622381884902897 | |
| 203.068 | Choline phosphate [+F(-)] | cpd:C00588 | 0 | 0 | 0 | 0 | 0.021136111745501136 | -0.0423987313330232 | 0.03239416063418857 | -0.07476905332359667 | 0.04120610634356786 | -0.06733304571611928 | 0.008746229306767163 | 0.025173283572093464 | -0.038913524260331935 | 0.02270419214703171 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -0.051772405367420546 | 0.06795283624308689 | -0.023951152448626077 | -0.023433843083505143 | -0.04841506150804083 | -0.10379760589904649 | 0.04928630302999161 | -0.012054269418712425 | 0.06957287744648386 | 0.025393614277039008 | 0.027744234028515533 | -0.018391583731580684 | 0.0943070921059717 | -0.26180998669129857 | |
| 203.082 | L-Tryptophan [-H(+)] | cpd:C00078 | -0.2373293115090422 | -0.11328570402662379 | -0.10329634201598463 | -0.1812407368682555 | 0.019806594516785923 | -0.05431994388152546 | 0.020429112114572115 | -0.012001100097152875 | 0.026322285059638302 | -0.011790796950568203 | -0.012470577424871725 | -0.002731792562919922 | 0.04765041800090932 | -0.05264957881744849 | -0.022709926524469015 | -0.02227173299649118 | -0.012646350644681675 | -0.11692457987841996 | -0.047816530906859465 | -0.008611745546929112 | 0.008419698029077525 | -0.00442692777664193 | -0.027104576097877607 | -0.018679157975969116 | -5.833124498135156E-4 | -0.03181715487661188 | 0.07051821457517034 | 0.015559355137197198 | 0.04843372363263695 | 0.023254572835114912 | -0.014216228837598948 | 0.0010795044502768223 | 0.004918669411037441 | -0.04365363753886976 | -0.00800423509589338 | 0.025514219440661106 | -0.015023707658793134 | -0.006502377550381849 | -0.004134036574946752 | -0.03992878529741083 | |
| 204.053 | Lipoamide [-H(+)] | cpd:C00248 | -0.13358305388430652 | -0.06412839859886357 | -0.08408289638430148 | -0.02626676901843127 | 0.022218945400876728 | 0.008231214594270914 | -0.027402896047662485 | -0.03043298098352438 | -0.03058391404541165 | 0.003048845419044766 | 0.02111797709494066 | -0.010468576449518785 | 0.0272250534185166 | 0.017154389421682646 | 0.05096047844727507 | 0.004937132118188324 | -0.07240599941786786 | -0.021831815641928473 | -0.13839434038766632 | 0.07386896580847632 | 0.06096214186425316 | 0.009173717577619396 | 0.00956556190698135 | 0.014288493122355122 | 0.0676643054336065 | 0.016184870535946028 | -0.037584745536147275 | 0.08758087432573101 | -0.07207402887615616 | -0.015044764652860927 | 0.00549066724310435 | 0.023514836520440657 | 0.003995668634441166 | 0.016334276668141443 | 0.0027101525891242146 | -0.08251026042957714 | 0.06484404782356078 | 0.03847016605972181 | -0.03635776362594111 | -0.007529483288672894 | |
| 206.068 | Dihydrolipoamide [-H(+)] | cpd:C00579 | 0.00979821610583586 | 0.0898783750285217 | 0.13302511885746762 | 0.11295289006166623 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.006848723742380537 | 0.07407181586323908 | -0.009608425320158508 | 0.024737343888393038 | -8.618438883966894E-4 | 0.0143270772453704 | 0.0014994777503828647 | -0.002709655095593382 | 0.0451383766574331 | -0.021969239518924488 | 0.083895168847252 | 0.030811959621882868 | -0.05864905159542036 | -0.04681047113044347 | |
| 213.015 | 2-Deoxy-D-ribose 1-phosphate [-H(+)] | cpd:C00672 | 0.17001726273460638 | 0.17319350257304544 | 0.19606523573855522 | 0.12569314328654074 | 0.021953616570862818 | 0.09216122025915678 | -0.07888964530722765 | 0.02369508560497322 | -0.007246096290026016 | 0.03581241092885709 | 0.17468825214066605 | -0.004236275959162628 | 0.0017260768262698273 | -0.01499207368353436 | -0.05391362242570726 | 0.0294694324167309 | 0.12866673349161925 | 0.03324563447200862 | 0.0849605825029883 | 0.02329598022519213 | 0.054201577032752114 | 0.004449556531661231 | -0.028707912506914502 | 0.05782102500584326 | 0.037516632738658844 | -0.0220307245875492 | -0.11122274649519848 | 0.12540229196900712 | -0.02403555768291516 | -0.03322143346783712 | -0.002850339213174463 | 0.013880494639626142 | 0.026725320741091945 | 0.0092533742715243 | 0.042343053136892427 | 0.0694966757099178 | -5.570751405622915E-4 | 0.007709153619373768 | -0.07242813707091424 | 0.07680831236273733 | |
| 223.086 | L-Tryptophan [+F(-)] | cpd:C00078 | 0 | 0 | 0 | 0 | 0.05859984503795796 | 0.021403045802579075 | -0.04487257819715497 | -0.07256912142672901 | 0.022623792340628324 | 0.013097855224324242 | -0.008914175429932862 | 0.019825747443473287 | -0.011940771441106503 | -0.03057235297053288 | 0.06005988442598622 | 0.052961950834702384 | -0.027760308420350207 | 0.04479581045257048 | -0.14168614165405416 | 0.6104687627421737 | 0.023866613413253013 | 0.00580176166116326 | -0.002198289573159013 | 0.041790448213459265 | 0.07767245461632823 | 0.00763399611538467 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 224.057 | Lipoamide [+F(-)] | cpd:C00248 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -0.04947937928500899 | -0.040608460908118024 | 0.012949685224898446 | 0.004904296484643979 | 0.0030348973381723616 | 0.04837996184221178 | 0.03832253862015664 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.03040198784283036 | -0.04719394307216202 | -0.14144452170415645 | 0.011380711443456395 | 0.05875195054159834 | 0.11724045255278495 | -0.15938618605429167 | 0.06027785162576476 | -0.06148495586621766 | -0.14155295676157323 | -0.15891370061491963 | 0.00573614271817897 | -0.17375996732062587 | 0.19270777521666446 | |
| 226.071 | Dihydrolipoamide [+F(-)] | cpd:C00579 | 0 | 0 | 0 | 0 | -0.005215974879119466 | 0.03497928500358146 | -0.06373614233086249 | -0.06277691676716583 | -0.02944343479963224 | 0.015086130955807945 | 0.0070157813904208185 | -0.017653234099935907 | 0.040471222837294096 | 0.0031036285421938816 | 0.36824346678153896 | 0.014559285846985761 | -0.007888598369971632 | 0.02240092196334543 | -0.07613613861978474 | 0.6933542138584045 | -0.015564760311758867 | 0.04743972259481279 | -0.00540780536604954 | 0.01381117930192635 | -0.04217691364999727 | -0.017360103868525902 | 0.047801790411708116 | 0.00767123305674555 | -0.05736131566832014 | 0.011423511632319652 | 0.02914824633679532 | 0.05469424369956032 | -0.060819115301751714 | 0.0015501906579151955 | -0.022196739585115657 | -0.08858929153684966 | 0.004372409824332632 | 0.02805324718217137 | -0.12532462567882932 | 0.10713243411922241 | |
| 226.084 | Deoxycytidine [-H(+)] | cpd:C00881 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -0.068333075169552 | 0.02381541161966511 | -0.004764313565168082 | -3.3045070124641666E-4 | 0.003700834193811997 | 0.013825769317430589 | 3.419614388368843E-4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 227.067 | Deoxyuridine [-H(+)] | cpd:C00526 | -0.09676608595627147 | 0.012282796688137147 | -0.014081871563461515 | -0.10257921611065039 | 0 | 0 | 0 | -0.0525818712505782 | -0.01798045511976819 | -0.013223806090247899 | 0.04669330550518128 | 0.003533733138278474 | 0.00607785503149366 | 0.015366219522507005 | 0.07223062564571146 | 0.01961517994613325 | -0.1015180498988573 | -0.018156040594773472 | -0.07515785756267994 | 0.4837009896849887 | -0.001496936214713048 | 0.04394107052252083 | -0.015378945244078913 | -0.018779652492021768 | 0.015627370224302918 | 6.127868494947279E-4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 229.012 | D-Ribose 5-phosphate [-H(+)] | cpd:C00117 | 0.008612674415826424 | -0.11618221922526636 | -0.21815621923979275 | -0.47525416842187584 | 0.05034137630795581 | -0.05834303361621517 | 0.07931759334134839 | -0.0574246908456306 | -0.07035080818012109 | -0.026869286595946333 | 0.24631595707069284 | -0.08430162252176181 | 0.023542710248117864 | -0.07892779170886599 | 0.011055763487865813 | 0.13290823614459465 | -0.24276344127836996 | 0.04675212586986031 | 0.21065234039402408 | 0.2013659406652518 | 0.06818853192326789 | 0.018370520441194076 | -0.11727999618885619 | -0.10147275403113314 | 0.07349045386999281 | -0.06936293749420017 | -0.01350878801778631 | 0.05687416053581026 | -0.09700556467019687 | -0.03683242896608186 | 0.0016509103223007987 | 0.02328085908120248 | 0.03593768212784803 | -0.08080150314689918 | -0.02025369043933134 | 0.05842771142578774 | 0.04701978813828868 | 0.0332308894909794 | 0.021144745135971456 | -0.06978716314711249 | |
| 241.086 | Thymidine [-H(+)] | cpd:C00214 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -0.02882123838028391 | 0.01385089691607509 | -0.03226166839755418 | -0.029880361055320624 | 0.0187326082366393 | 0.021375174603784672 | -0.031435541219956696 | 0.067986621406717 | 0.11912221388268958 | -0.1353432801250413 | -0.0479575669280881 | -0.08472828444540365 | -0.3145882684030756 | 0.03941485848006929 | -0.026627510872715695 | 0.03006377226691142 | 0.044083316905057686 | 0.10368911209593337 | 0.08964490723139386 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 242.079 | Cytidine [-H(+)] | cpd:C00475 | -0.07865987704426038 | -0.08811419053697948 | -0.09285672948227638 | -0.11807547049785148 | -0.006223044236978403 | 0.0017499022638068407 | -0.01267809087412834 | -0.00884479220755777 | -0.006938884708296954 | -0.006473457916388407 | -0.020442595873923077 | -0.01409317467208472 | 0.04094758470501548 | -0.0197093500835419 | -0.002230265339814812 | 0.04154732673671537 | -0.22098299640454366 | -0.07556503843909884 | -0.13289419050025572 | -0.017599793613843662 | 0.030714473817684013 | -0.08300845810212087 | -2.697530401925962E-4 | 0.02150243191310129 | 0.06074983262182665 | 0.039895205441941424 | -0.004052363494915137 | -0.10385200039126259 | 0.007080415907423182 | 0.056123443170297625 | 0.04168204391755113 | 0.07600592459006764 | 0.007640660013813919 | 0.004846711830183234 | -0.012920334149743447 | -0.05585499432983876 | -0.05716558246653417 | -0.049621234016459716 | -0.06889381012944577 | -0.13232726755042779 | |
| 243.063 | Uridine [-H(+)] | cpd:C00299 | -0.24606926736844878 | -0.24827924474858304 | -0.21468786576633966 | -0.1919155533599157 | 0.002746706100478473 | -0.06184653109623308 | 0.05959578804224841 | -0.0250559928941753 | 0.033253827446600284 | -0.012080697470089382 | 0.006517940508382471 | 0.03890563031681386 | -0.016983237185421215 | 0.042383338580232126 | 0.08189340003083057 | 0.04251339387519126 | -0.12216843973681607 | -0.07793143441320778 | -0.03026849815009806 | 0.07040301577142184 | 0.03304264406027281 | -0.04179917339341938 | -0.04609202556639328 | -0.007927320307783849 | 0.031289947072299186 | 0.046265817867768844 | 0.11103774000536695 | -0.021317259573373673 | 0.005121830883935198 | 3.5328695877067854E-4 | -9.886096081116928E-4 | 0.019302859768928805 | 0.02675460219602518 | -0.011116007850565273 | 0.03183206946842869 | -0.005058809592624336 | 0.0318429518410669 | -0.06151050139578736 | 0.027758748086905705 | -0.14070614769588727 | |
| 246.015 | Pyridoxal phosphate [-H(+)] | cpd:C00018 | -0.09956002907829518 | -0.008406149674613651 | 0.022245714979678054 | 0.0845402689093396 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.10601475078480274 | -0.14505684724942017 | -0.06851093798129729 | 0.07766771127134371 | 0.12312832092988403 | 0.18076548922260027 | -0.0692713810349846 | 0.03284244923474778 | -0.03366553971630439 | -0.11999518064620152 | -0.01044670483324395 | 0.03882691890169037 | -0.2958045349478777 | 0.16735449548268294 | |
| 246.088 | Deoxycytidine [+F(-)] | cpd:C00881 | 0 | 0 | 0 | 0 | 0.04612796630707018 | 0.027080627318169726 | -0.0647978172461188 | -0.0362213865886108 | -0.00626940953452826 | -0.021968153659062475 | 0.021491158580709185 | 0.029956696370121008 | -0.014964715935656346 | -0.0012116493086467602 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.06828749472644925 | 0.029480306425747834 | 0.003336964258878024 | 0.03143456504180281 | -0.002887697660503405 | -0.023725177868512894 | -0.016523206473807804 | -0.06166495345117532 | 0.03067104737361033 | 1.2760424695962863E-4 | 0.031227650676751036 | 0.03768290140315582 | -0.06475793777049106 | -0.06410585779016695 | |
| 250.094 | Deoxyadenosine [-H(+)] | cpd:C00559 | 0 | 0 | 0 | 0 | -0.00846389387274439 | -0.03495836586437662 | -0.006625957538190332 | 0.041993956322848296 | -0.23553781491437967 | 0.10832307423245556 | -0.07768384972648021 | -0.20713493751993994 | 0.18547173163112143 | -0.003833803576766252 | -0.09243059752271941 | 0.051560579845528434 | -0.14819559387938672 | 0.19724148065200306 | 0.06889386689302879 | 0.1895746839443564 | -0.09794885223595566 | 0.012104426627499597 | -0.0043647573802461665 | -0.0020514269034137295 | -0.025311809174200946 | -0.06418293724455076 | 0.1163020551233933 | -0.6179323217999313 | -0.18700904580126185 | 0.16969695731331574 | 0.22849201728442914 | 0.33774380020639067 | -0.1392961323031624 | 0.19844329489955703 | -0.14102654134443077 | -0.32149683139511204 | -0.05758953738613537 | 0.022187759952680932 | -0.5780471959121581 | -0.09001963801251983 | |
| 257.104 | sn-Glycero-3-phosphocholine [-H(+)] | cpd:C00670 | -0.029147213088089867 | 0.04637287151919762 | 0.0945295197812911 | -0.0022823018130890774 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |
| 259.024 | D-Fructose 6-phosphate [-H(+)] | cpd:C00085 | -0.11819236966694038 | -0.1779912054419747 | -0.18299288300963987 | -0.27745305742644427 | 0.05866913405910038 | 0.12629439464165546 | -0.04389481439980461 | 0.012986836364544107 | -0.05274567351577946 | -0.05755984517540859 | -0.05153780019744309 | -0.1158261518327213 | 0.0997945990642334 | -0.004551688530755026 | -0.030288656746366327 | -0.008926716639957095 | -0.01776426506883588 | -0.10114669602005952 | -0.16654186986685043 | -0.26068824541139535 | 0.09744431443434189 | 0.09851524789305935 | 0.09659164360417846 | 0.036180137703131124 | 0.0620346196006301 | -0.008804418588696558 | -0.11607048871759033 | -0.024685503431555456 | -0.0224490107657111 | -0.013056468307379453 | 0.06533200860261953 | 0.08902173538930422 | 0.04488630787975186 | 0.02745081178228425 | 0.07541351761456808 | -0.05039415700707867 | 0.02532282289813621 | 0.06782190618169713 | -0.2237245455455812 | 0.11664560770401346 | |
| 261.043 | D-Mannitol 1-phosphate [-H(+)] | cpd:C00644 | -0.10615240256009807 | -0.1233078211114855 | -0.10819531710342589 | -0.0758835041610784 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.03792503820627446 | -0.01900690031911842 | 0.06337557347081049 | -0.04644799692850818 | -0.06596211494263997 | -0.03035468296425296 | 0.0885672456743605 | 0.09129372104758943 | 0.01814529060471934 | -0.009648428363918854 | -0.05225501475554777 | 0.010653656169513873 | 0.002432916845969411 | -0.04232152505226285 | -0.13683294856259662 | -0.00721809821272125 | 0.004711790652318503 | 0.002639796562532058 | 0.027357274162302735 | -0.012239772003132752 | 0.027923526181661978 | -0.0930492042671671 | -0.022784255904604624 | -0.023643828367136483 | -0.02219043245143774 | 0.31207551397784117 | |
| 261.088 | Thymidine [+F(-)] | cpd:C00214 | 0 | 0 | 0 | 0 | 0.011361861992824162 | -0.040614098245947756 | 0.002504927101880267 | -0.03879258328990931 | 0.019008568428187253 | -0.017143345159685127 | -0.030935600748048908 | 0.02742436512313649 | 0.02246338282486457 | -0.007574098099592938 | 0.13466799901411708 | 0.05676717257421017 | -0.16069839378377448 | -0.10208638168684701 | -0.18286476422057657 | -0.17334464699819677 | 0.08029494976507592 | 0.034316950988580217 | 0.014994926750172392 | 0.013791703667107988 | 0.054816692730023306 | 0.03167808248835447 | 0.07493275443138848 | 0.03332811566453637 | 0.022719445409087196 | 0.012026850306505996 | 0.009648244991940594 | 0.036201440801968444 | 0.01808736497927833 | -0.026322302951942485 | 0.011612449474028775 | -0.018503506743467384 | 0.03849688772011348 | -0.011578595139056866 | -0.003606783204593309 | 0.014869422763649052 | |
| 264.107 | Thiamine [-H(+)] | cpd:C00378 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -0.08095371513111096 | 0.026688835137598718 | -0.019292921997176027 | -0.002193748336013016 | 0.029453421247068522 | 0.007455777052216767 | -0.04063515162323602 | 7.489791937111259E-4 | 0.06631986451706345 | -0.08982797880790079 | 0.08669279966195675 | 0.008787982215124593 | 0.0953355623961441 | 0.008070049905252605 | 0.029970504153950382 | 0.013341336726320267 | 0.06527933556740588 | 0.08578837261645443 | 0.055909034068459935 | 0.011969108690064704 | 0.2936968686472913 | -0.022333880874736787 | -0.005076982031200321 | 0.01892504713051572 | 0.02197881813760417 | 0.059961486367284766 | 0.015247207002714178 | 0.06308457238204473 | -0.07966132984191636 | 0.2210589647184584 | 0.07965130418280877 | -0.060508383339978766 | -0.038361020154610535 | |
| 264.95 | 3-Phospho-D-glyceroyl phosphate [-H(+)] | cpd:C00236 | 0 | 0 | 0 | 0 | 0.02254179588201502 | -0.06547716422012156 | 0.03161986211278123 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 |
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| # Fold change values for perturbations including P-value, not corrected for batch effect | ||||||||||||||||||||||||||||||||||||||||||||||||||||
| GroupID | Glucose starvation_normal_perturbation_3 | Glucose starvation_normal_perturbation_3 | Glu_perturbation_6 | Glu_perturbation_6 | Glucose_starv_perturbation_7 | Glucose_starv_perturbation_7 | WT_noGluc_glucose starvation_7 | WT_noGluc_glucose starvation_7 | __ | Amino acid starvation_normal_perturbation_3 | Amino acid starvation_normal_perturbation_3 | AA_perturbation_6 | AA_perturbation_6 | __ | Iron limitation_normal_perturbation_3 | Iron limitation_normal_perturbation_3 | Fe_perturbation_6 | Fe_perturbation_6 | __ | Oxidative stress_normal_perturbation_3 | Oxidative stress_normal_perturbation_3 | Ox_perturbation_6 | Ox_perturbation_6 | __ | Glycerol as C-source_normal_perturbation_3 | Glycerol as C-source_normal_perturbation_3 | Gly_perturbation_6 | Gly_perturbation_6 | Gly_ctrl_perturbation_7 | Gly_ctrl_perturbation_6 | Tn051_Gly_perturbation_7 | Tn051_Gly_perturbation_7 | Tn420_Gly_perturbation_7 | Tn420_Gly_perturbation_7 | __ | unclear_Ade_normal_perturbation_3 | unclear_Ade_normal_perturbation_3 | |||||||||||||||
| PERTURBATION | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | Glucose starvation | |||||||||||||||
| Name of experiment to find the conditions | Glucose starvation | Glucose starvation | Glu | Glu | Glucose_starv | Glucose_starv | WT_noGluc | WT_noGluc | Amino acid starvation | Amino acid starvation | AA | AA | Iron limitation | Iron limitation | Fe | Fe | Oxidative stress | Oxidative stress | Ox | Ox | Glycerol as C-source | Glycerol as C-source | Gly | Gly | Gly_ctrl | Gly_ctrl | Tn051_Gly | Tn051_Gly | Tn420_Gly | Tn420_Gly | unclear_Ade | unclear_Ade | ||||||||||||||||||||
| BATCH | 3 | 3 | 6 | 6 | 7 | 7 | 7 | 7 | 3 | 3 | 6 | 6 | 3 | 3 | 6 | 6 | 3 | 3 | 6 | 6 | 3 | 3 | 6 | 6 | 7 | 6 | 7 | 7 | 7 | 7 | 3 | 3 | ||||||||||||||||||||
| CONDITIONS | grown without glucose and washed without glucose | grown without glucose and washed with glucose | grown without glucose and washed without glucose | grown with glucose and washed without glucose | Amino acid stringent response by addying SHX. Washed without glucose | Amino acid stringent response by addying SHX. Washed with glucose | Iron starvation. Washed without glucose | Iron starvation. Washed with glucose | Oxidative stress. Washed without glucose | Oxidative stress. Washed with glucose | Glycerol as C-source instead of Glucose. Washed without glucose | Glycerol as C-source instead of Glucose. Washed with glucose | Glycerol as C-source instead of Glucose. Washed with glucose | Glycerol as C-source instead of Glucose. Washed with glucose | Glycerol as C-source instead of Glucose. Washed with glucose | Adenine added to the medium. Washed without glucose | Adenine added to the medium. Washed without glucose | |||||||||||||||||||||||||||||||||||
| Glucose washed | 0 | 1 | 0 | 0 | 0 | 1 | 0 | 1 | 0 | 1 | 0 | 1 | 1 | 1 | 1 | 0 | 0 | |||||||||||||||||||||||||||||||||||
| normal_perturbation | normal_perturbation | perturbation | perturbation | perturbation | perturbation | glucose starvation | glucose starvation | normal_perturbation | normal_perturbation | perturbation | perturbation | normal_perturbation | normal_perturbation | perturbation | perturbation | normal_perturbation | normal_perturbation | perturbation | perturbation | normal_perturbation | normal_perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | normal_perturbation | normal_perturbation | |||||||||||||||||||||
| REFERENCE | CTL | CTL | WT | WT | WT | WT | WT | WT | CTL | CTL | WT | WT | CTL | CTL | WT | WT | CTL | CTL | WT | WT | CTL | CTL | WT | WT | WT | WT | Tn051 | Tn051 | Tn420 | Tn420 | CTL | CTL | ||||||||||||||||||||
| Protein KO (KO),overexpressed (TF) | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | WT | Tn051 | Tn051 | Tn420 | Tn420 | unclear_Ade | unclear_Ade | ||||||||||||||||||||
| m/z | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | ||||||
| 59.015 | Acetate [-H(+)] | cpd:C00033 | -1.84835627 | 4.0E-8 | -0.88249942 | 0.0012937 | -1.61303227 | 0.0036186 | -1.17699878 | 1.2965E-4 | 0.10161055 | 0.28497244 | -0.41962544 | 0.04527333 | -0.0564427 | 0.07170334 | -0.43558198 | 0.03025433 | 0.00535049 | 0.91677331 | -0.16196736 | 0.52948101 | 0.1152838 | 0.38190923 | -0.13708371 | 0.20117158 | -0.0187171 | 0.41468644 | -0.31269645 | 0.26927839 | 0.33572239 | 0.15177837 | 1.19000112 | 1.0258E-4 | ||||||||||||||||||
| 492.163 | 10-Formyltetrahydrofolate [+F(-)] | cpd:C00234 | Folinic acid [+F(-)] | cpd:C03479 | -0.3360511 | 0.07206483 | -0.48258299 | 0.00554315 | -0.3407339 | 0.19796742 | -0.5939961 | 0.02151461 | 0.81741654 | 0.08564438 | ||||||||||||||||||||||||||||||||||||||
| 472.154 | 10-Formyltetrahydrofolate [-H(+)] | cpd:C00234 | Folinic acid [-H(+)] | cpd:C03479 | -0.1271999 | 0.41597654 | 0.09711016 | 0.71447491 | 0.27203737 | 0.54263204 | 0.57284908 | 0.00118518 | 0.13261667 | 0.43283908 | -0.45241671 | 5.895E-5 | ||||||||||||||||||||||||||||||||||||
| 213.015 | 2-Deoxy-D-ribose 1-phosphate [-H(+)] | cpd:C00672 | 2-Deoxy-D-ribose 5-phosphate [-H(+)] | cpd:C00673 | -0.49821682 | 0.03315506 | 0.29275908 | 0.00824002 | -0.31167242 | 0.1532412 | -0.25718067 | 0.16502347 | -0.17945393 | 0.36756839 | -0.27897715 | 0.00400562 | -0.07408443 | 0.70377321 | -0.06271131 | 0.61071735 | 0.04016674 | 0.19105016 | -0.01080623 | 0.69869915 | 0.22052378 | 0.03300317 | -0.02745213 | 0.67059562 | 0.47381542 | 0.27027424 | -0.18345258 | 0.24496108 | 0.48907685 | 0.1948981 | 0.09805565 | 0.17892362 | ||||||||||||||||
| 273.005 | 3-Dehydro-L-gulonate 6-phosphate [-H(+)] | cpd:C14899 | -0.97581119 | 5.8E-7 | -0.09426554 | 0.1964941 | -0.29196078 | 2.9792E-4 | -0.12747064 | 0.83225319 | -0.09376289 | 0.10357498 | -0.19924355 | 0.16163132 | -0.29565878 | 0.05330091 | 0.01677999 | 0.46660278 | -0.3779526 | 0.05305537 | 0.7696861 | 0.22268522 | 0.7692915 | 0.01721118 | ||||||||||||||||||||||||||||
| 184.988 | 3-Phospho-D-glycerate [-H(+)] | cpd:C00197 | 2-Phospho-D-glycerate [-H(+)] | cpd:C00631 | -1.3751137 | 6.258E-5 | 0.06101937 | 0.35725835 | -0.6451985 | 0.04718425 | -0.7569237 | 0.0022414 | 1.40058456 | 2.468E-5 | 0.82031881 | 9.7198E-4 | 0.43943639 | 0.01184618 | 0.02985791 | 0.88802745 | -1.16131678 | 3.3473E-4 | -0.64063839 | 7.5715E-4 | 0.39896122 | 0.02805301 | -0.73042964 | 0.00957048 | -0.00520345 | 0.45036717 | 0.13395089 | 0.65326655 | 0.22958829 | 0.29472439 | 1.5085445 | 7.3217E-4 | ||||||||||||||||
| 284.96 | 3-Phospho-D-glyceroyl phosphate [+F(-)] | cpd:C00236 | ||||||||||||||||||||||||||||||||||||||||||||||||||
| 264.95 | 3-Phospho-D-glyceroyl phosphate [-H(+)] | cpd:C00236 | ||||||||||||||||||||||||||||||||||||||||||||||||||
| 475.163 | 5,10-Methenyltetrahydrofolate [+F(-)] | cpd:C00445 | ||||||||||||||||||||||||||||||||||||||||||||||||||
| 455.159 | 5,10-Methenyltetrahydrofolate [-H(+)] | cpd:C00445 | -0.41699059 | 0.00619868 | 0.83147746 | 1.1946E-4 | 0.06917973 | 0.94193942 | 0.09214212 | 0.2527316 | -0.01706747 | 0.85328471 | -0.19713317 | 0.14730243 | ||||||||||||||||||||||||||||||||||||||
| 476.167 | 5,10-Methylenetetrahydrofolate [+F(-)] | cpd:C00143 | -0.41734517 | 0.19625386 | 0.15960229 | 0.21269975 | 0.45349875 | 0.10445141 | -1.73839784 | 0.00102729 | -0.19783261 | 0.75008027 | ||||||||||||||||||||||||||||||||||||||||
| 408.947 | 5-Phospho-alpha-D-ribose 1-diphosphate [+F(-)] | cpd:C00119 | -0.56333255 | 0.05146246 | -0.5007061 | 0.00278085 | 0.54743515 | 0.83134054 | 0.10901644 | 0.19642135 | 0.28495478 | 0.24478126 | ||||||||||||||||||||||||||||||||||||||||
| 388.945 | 5-Phospho-alpha-D-ribose 1-diphosphate [-H(+)] | cpd:C00119 | -1.8845251 | 2.34E-6 | -0.12363035 | 0.17651217 | -0.19450717 | 0.67280926 | 0.2622371 | 0.18012137 | 0.08625968 | 0.58139063 | -1.05353398 | 9.342E-5 | 0.32639248 | 0.11324817 | 0.09822875 | 0.61919821 | -0.51701913 | 0.13723054 | 0.54034842 | 0.14869814 | 1.19129165 | 0.00792138 | ||||||||||||||||||||||||||||
| 138.98 | Acetyl phosphate [-H(+)] | cpd:C00227 | -0.76810458 | 9.2976E-4 | -0.20915401 | 0.12527184 | -0.42383249 | 0.04565529 | 0.14919402 | 0.08842557 | -0.43153494 | 0.0127459 | 0.02961472 | 0.2373706 | ||||||||||||||||||||||||||||||||||||||
| 808.118 | Acetyl-CoA [-H(+)] | cpd:C00024 | 0.12725809 | 0.931453 | 0.28610672 | 0.24559229 | -0.24708668 | 0.35191118 | -0.75476465 | 0.02683937 | -0.20142085 | 0.25867723 | -1.02735724 | 0.00813779 | -0.26338321 | 0.50447469 | -0.13208206 | 0.41285801 | -0.02087993 | 0.63608504 | 0.6123151 | 0.17985235 | 0.71376614 | 0.05363017 | ||||||||||||||||||||||||||||
| 154.052 | Adenine [+F(-)] | cpd:C00147 | -1.75034706 | 9.421E-5 | -1.06165789 | 0.00165389 | -0.78346884 | 0.05238805 | -0.39790077 | 0.21431625 | 0.94742071 | 0.13547272 | ||||||||||||||||||||||||||||||||||||||||
| 134.047 | Adenine [-H(+)] | cpd:C00147 | -1.40555486 | 8.0E-8 | 1.82315788 | 1.197E-5 | 0.45274449 | 0.06615558 | 0.11751626 | 0.00660919 | -0.17732164 | 2.1056E-4 | 1.66773607 | 2.426E-5 | -0.06316283 | 0.17088271 | 1.72436463 | 3.096E-5 | -0.02580776 | 0.28882583 | 1.518879 | 9.5113E-4 | -0.15619325 | 0.00277372 | 1.35528547 | 5.389E-5 | -0.04494525 | 0.30318551 | -0.05652671 | 0.07464525 | 0.05424736 | 0.68138185 | 1.60638709 | 3.06E-6 | ||||||||||||||||||
| 286.094 | Adenosine [+F(-)] | cpd:C00212 | Deoxyguanosine [+F(-)] | cpd:C00330 | 0.09150274 | 0.28453351 | 0.11851921 | 0.66961153 | -0.25207265 | 0.00386391 | 1.42355998 | 3.9280000000000003E-5 | 1.67578451 | 1.235E-5 | -0.03239793 | 0.60793188 | 1.38462278 | 5.336E-5 | -0.01744071 | 0.72464095 | -0.84078719 | 0.01297776 | 1.42882324 | 0.09426849 | ||||||||||||||||||||||||||||
| 266.089 | Adenosine [-H(+)] | cpd:C00212 | Deoxyguanosine [-H(+)] | cpd:C00330 | ||||||||||||||||||||||||||||||||||||||||||||||||
| 426.022 | ADP [-H(+)] | cpd:C00008 | Adenosine 3',5'-bisphosphate [-H(+)] | cpd:C00054 | dGDP [-H(+)] | cpd:C00361 | -2.14655477 | 1.4377E-4 | 0.47229813 | 0.0375977 | 0.58347242 | 0.24371366 | 0.14730053 | 0.8391364 | -0.68076729 | 0.04560099 | -1.04193608 | 0.01212985 | -0.29984063 | 0.42832344 | -1.41690471 | 0.00406351 | -3.53761485 | 2.015E-5 | -3.87332324 | 6.6E-7 | -0.21465195 | 0.72961117 | -1.08406797 | 0.00142294 | -0.15030794 | 0.40241184 | 0.05283979 | 0.86266098 | -0.30650295 | 0.86373604 | 1.82406971 | 0.00667534 | ||||||||||||||
| 346.057 | AMP [-H(+)] | cpd:C00020 | dGMP [-H(+)] | cpd:C00362 | -1.17834562 | 1.415E-5 | 1.04647224 | 0.00256415 | 0.34546778 | 0.21842627 | -0.00258727 | 0.80494761 | -0.10864144 | 0.29739807 | 0.1816274 | 0.12326658 | -0.03365674 | 0.47022272 | -0.20038454 | 0.47961243 | -0.64871359 | 0.00730929 | -0.52098364 | 0.01987486 | -0.22950576 | 0.05808722 | -0.36311016 | 0.12565681 | -0.17619718 | 0.16420059 | 0.39959531 | 0.43056341 | -0.14711161 | 0.82282451 | 1.03373926 | 0.00268231 | ||||||||||||||||
| 195.029 | Ascorbate [+F(-)] | cpd:C00072 | -0.85698213 | 0.00573545 | -1.07336425 | 0.28634183 | -0.98576571 | 2.2716E-4 | -0.11955714 | 0.19244917 | -0.36704854 | 0.07973185 | -0.1863804 | 0.20981138 | -0.53176608 | 0.02000708 | 0.12206642 | 0.87042927 | -0.38892625 | 0.05950895 | 0.76360117 | 0.08046953 | ||||||||||||||||||||||||||||||
| 175.026 | Ascorbate [-H(+)] | cpd:C00072 | -1.05589003 | 4.4158E-4 | -0.1239259 | 0.28349151 | -0.34102059 | 0.03973874 | -0.61490106 | 1.243E-4 | -0.1784748 | 0.04540605 | 1.0926353 | 0.01497485 | -0.77720132 | 0.03153715 | 0.65376825 | 0.69968481 | -1.43791207 | 0.00647959 | 2.43434534 | 0.11510594 | ||||||||||||||||||||||||||||||
| 525.996 | ATP [+F(-)] | cpd:C00002 | dGTP [+F(-)] | cpd:C00286 | 0.09350403 | 0.71753687 | -0.21835174 | 0.00599904 | 0.09441595 | 0.76765293 | -0.39780557 | 0.00300532 | 0.84066704 | 0.06966116 | ||||||||||||||||||||||||||||||||||||||
| 505.991 | ATP [-H(+)] | cpd:C00002 | dGTP [-H(+)] | cpd:C00286 | -0.09649013 | 0.88341466 | 1.62758297 | 0.00109019 | 0.16294578 | 0.82539899 | -0.03753748 | 0.94660784 | 0.4573774 | 0.11356463 | -0.76606092 | 0.49863535 | -0.26379291 | 0.03654561 | -0.80736223 | 0.01572696 | -1.19619339 | 3.473E-5 | -1.55685925 | 5.8E-7 | -0.29917419 | 0.04800432 | -0.28538185 | 0.08515453 | -0.11972829 | 0.19529001 | -0.09096711 | 0.62757828 | 0.8023209 | 0.15806694 | 0.77898163 | 0.02018918 | ||||||||||||||||
| 159.977 | Carbamoyl phosphate [+F(-)] | cpd:C00169 | -0.61133934 | 0.077841 | -0.05760432 | 0.3750703 | -0.15583025 | 0.41231081 | -0.23519865 | 0.5302783 | -0.74888423 | 0.03475782 | 0.07169639 | 0.3321959 | -0.84779097 | 0.02110785 | 0.08297424 | 0.97580264 | -0.85868785 | 0.13581244 | 0.55001315 | 0.22814602 | ||||||||||||||||||||||||||||||
| 139.975 | Carbamoyl phosphate [-H(+)] | cpd:C00169 | 0.30913456 | 0.73916462 | -0.09630655 | 0.39963078 | 0.20912901 | 0.73414419 | -0.16895104 | 0.6709862 | 0.18686321 | 0.32684797 | ||||||||||||||||||||||||||||||||||||||||
| 402.011 | CDP [-H(+)] | cpd:C00112 | 0.96400903 | 7.0933E-4 | 0.41499375 | 0.45832437 | 0.34207267 | 0.462749 | 0.24042016 | 0.09700094 | -0.07220081 | 0.30743651 | -1.95065914 | 6.55E-6 | 0.23361636 | 0.06122673 | 0.11181903 | 0.86281969 | 0.29041383 | 0.81215745 | -0.17776856 | 0.95573577 | ||||||||||||||||||||||||||||||
| 507.102 | CDP-choline [+F(-)] | cpd:C00307 | ||||||||||||||||||||||||||||||||||||||||||||||||||
| 487.1 | CDP-choline [-H(+)] | cpd:C00307 | 0.10937526 | 0.32942183 | -0.62800602 | 0.00554851 | -0.65052328 | 0.00138976 | 1.29970273 | 8.658E-5 | 0.28005474 | 0.07089414 | 1.06484343 | 4.1271E-4 | 0.38970986 | 0.06509854 | -0.36948103 | 0.01876876 | -0.47154201 | 0.01842697 | 0.92166522 | 0.12460551 | ||||||||||||||||||||||||||||||
| 203.068 | Choline phosphate [+F(-)] | cpd:C00588 | 0.59665225 | 0.00560062 | 0.32532602 | 0.00592517 | 0.12350413 | 0.15912747 | 0.1053702 | 0.47292183 | -0.65090565 | 0.4112098 | ||||||||||||||||||||||||||||||||||||||||
| 183.067 | Choline phosphate [-H(+)] | cpd:C00588 | -0.43802866 | 3.8102E-4 | -0.77265229 | 0.03714907 | -0.3963982 | 0.03528858 | 0.26536849 | 0.04224328 | 0.20312119 | 0.04820122 | 0.42384529 | 2.0695E-4 | 0.24869826 | 0.18118349 | 0.16308061 | 0.9294504 | -0.53913361 | 0.08975902 | 0.95112845 | 0.11484165 | 0.21080122 | 0.06620311 | ||||||||||||||||||||||||||||
| 342.05 | CMP [+F(-)] | cpd:C00055 | 0.13583979 | 0.44670231 | -0.12383164 | 0.52679871 | -0.10884448 | 0.12239211 | -1.25109479 | 3.96E-4 | -0.39034492 | 0.05356794 | ||||||||||||||||||||||||||||||||||||||||
| 322.045 | CMP [-H(+)] | cpd:C00055 | -0.22995295 | 0.02221884 | -0.13893721 | 0.02075472 | 0.26083 | 0.0502931 | 0.2046577 | 1.0232E-4 | -0.06060217 | 0.45533441 | 0.02151884 | 0.53913643 | 0.18716384 | 0.05514994 | 0.14408462 | 0.17953193 | 0.08869429 | 0.20828095 | -0.31115934 | 0.00894291 | -0.10618167 | 0.06943742 | -0.29359042 | 0.00799306 | -0.07176912 | 0.81258596 | 0.27819701 | 0.0221244 | -0.43250126 | 0.11156625 | 0.0175362 | 0.42097465 | ||||||||||||||||||
| 766.11 | CoA [-H(+)] | cpd:C00010 | -0.4535347 | 0.01565741 | -0.636322 | 0.00498765 | -0.93159953 | 0.03431423 | -0.15035078 | 0.20620672 | 0.33379439 | 0.23798612 | ||||||||||||||||||||||||||||||||||||||||
| 501.978 | CTP [+F(-)] | cpd:C00063 | 0.37392894 | 0.0459038 | 0.20644004 | 0.02149358 | -0.06272064 | 0.88622959 | -0.29687165 | 0.0428238 | 0.5839119 | 0.1051352 | ||||||||||||||||||||||||||||||||||||||||
| 481.978 | CTP [-H(+)] | cpd:C00063 | 0.10479318 | 0.19627602 | -0.09645372 | 0.24317088 | -0.14126295 | 0.11423658 | 0.47916499 | 8.6154E-4 | -0.09673323 | 0.15800199 | -0.31241881 | 0.02814325 | -0.29235193 | 0.01487056 | 0.0241561 | 0.47419598 | -0.54241573 | 0.0118782 | 0.73343428 | 0.07616428 | 0.0563056 | 0.82000417 | ||||||||||||||||||||||||||||
| 677.1 | Cyclic di-3',5'-adenylate [+F(-)] | cpd:C20565 | ||||||||||||||||||||||||||||||||||||||||||||||||||
| 657.094 | Cyclic di-3',5'-adenylate [-H(+)] | cpd:C20565 | -0.1245571 | 0.09385194 | 0.15336312 | 0.02675219 | 0.07125432 | 0.25887932 | 1.05795592 | 1.7738E-4 | 0.13750357 | 0.08810422 | -0.27988126 | 0.01104146 | ||||||||||||||||||||||||||||||||||||||
| 242.079 | Cytidine [-H(+)] | cpd:C00475 | -0.11433061 | 0.04640805 | -0.58183137 | 0.09638031 | 0.34627929 | 0.00222131 | -0.28857312 | 0.00325223 | 0.08954239 | 0.42010958 | 0.24618082 | 0.02751374 | 0.09154819 | 0.1474905 | 0.38606559 | 7.6767E-4 | 0.28226513 | 0.00593331 | 0.19560927 | 0.00836737 | 0.05539776 | 0.96398999 | 0.04174231 | 0.67637266 | -0.16945641 | 0.04841574 | 0.16072842 | 0.01023611 | -0.21794261 | 0.43953769 | -0.10458376 | 0.3869898 | ||||||||||||||||||
| 430.036 | dADP [+F(-)] | cpd:C00206 | -0.59826761 | 0.00107617 | 0.07284948 | 0.88643043 | -0.90721938 | 0.01699012 | -0.30386236 | 0.13248642 | -0.32162292 | 0.02062139 | ||||||||||||||||||||||||||||||||||||||||
| 410.027 | dADP [-H(+)] | cpd:C00206 | 0.46009019 | 0.00743249 | 0.01709572 | 0.77658655 | 0.22705688 | 0.50676839 | -0.59271959 | 0.02308555 | -0.39281507 | 0.22052794 | -1.59211988 | 4.9072E-4 | -0.79835126 | 0.00118535 | -0.51113727 | 0.18012246 | -0.11611834 | 0.84099536 | 0.00276947 | 0.4327973 | ||||||||||||||||||||||||||||||
| 330.062 | dAMP [-H(+)] | cpd:C00360 | -0.83559528 | 6.9265E-4 | -0.21662147 | 0.55027849 | -0.3728485 | 0.41968873 | 0.1612988 | 0.51080749 | -0.37218465 | 0.02694178 | -0.84077636 | 0.01096537 | 0.33691252 | 0.28501025 | -0.68948879 | 0.0039704 | -0.61173198 | 0.05735719 | -0.84264895 | 0.0117583 | -0.32182837 | 0.13237347 | -0.84888266 | 0.00423652 | -0.05759551 | 0.3512031 | -0.00443133 | 0.36168489 | 0.50406818 | 0.09872505 | 1.18425187 | 0.00503907 | ||||||||||||||||||
| 510.004 | dATP [+F(-)] | cpd:C00131 | -0.18623951 | 0.0501102 | -0.05618294 | 0.2390208 | -0.24459963 | 0.00935419 | -0.01555812 | 0.88404789 | 0.26775467 | 0.26090656 | ||||||||||||||||||||||||||||||||||||||||
| 489.993 | dATP [-H(+)] | cpd:C00131 | 0.45447561 | 0.19215964 | 0.17865325 | 0.56052572 | 0.07258972 | 0.93228072 | -0.01590989 | 0.25956558 | 0.2918391 | 0.27359651 | ||||||||||||||||||||||||||||||||||||||||
| 406.017 | dCDP [+F(-)] | cpd:C00705 | ||||||||||||||||||||||||||||||||||||||||||||||||||
| 386.016 | dCDP [-H(+)] | cpd:C00705 | -0.62449623 | 0.00361081 | 0.2423582 | 0.09627699 | 0.20128804 | 0.72908295 | 0.25965323 | 0.4591691 | -0.44513353 | 0.01287906 | -0.21991043 | 0.09967449 | 0.71681974 | 0.00577376 | 0.00118077 | 0.55856936 | -0.70059763 | 0.00150664 | -1.21221179 | 0.00106102 | -0.01753474 | 0.69366329 | -0.38964918 | 0.00428562 | -0.38135386 | 0.27952777 | 0.10969841 | 0.96729185 | -0.00809009 | 0.4307429 | 0.59789503 | 0.00624819 | ||||||||||||||||||
| 326.059 | dCMP [+F(-)] | cpd:C00239 | -0.06073076 | 0.82013283 | -0.218275 | 0.01991374 | -0.1829706 | 0.20105413 | -0.46042244 | 4.1338E-4 | 0.48394691 | 0.16158067 | ||||||||||||||||||||||||||||||||||||||||
| 306.049 | dCMP [-H(+)] | cpd:C00239 | -0.11913364 | 0.15275439 | -0.53844775 | 6.2001E-4 | -0.40149146 | 0.0382416 | -0.01434934 | 0.56848577 | -0.15042438 | 0.25744612 | -0.49133962 | 0.01267228 | 0.42223659 | 4.349E-4 | -0.44492961 | 0.01148078 | 0.03398469 | 0.27842697 | -0.41445413 | 0.01118297 | -0.00309951 | 0.82594512 | -0.5023822 | 0.00668888 | -0.3060608 | 0.03093173 | -0.21220099 | 0.1655674 | 0.42830611 | 0.14089768 | 0.50831415 | 0.00358679 | ||||||||||||||||||
| 465.981 | dCTP [-H(+)] | cpd:C00458 | -0.33962312 | 0.09026025 | 0.10417097 | 0.95811155 | 0.0070733 | 0.93523807 | 0.0239521 | 0.89009162 | -0.15607047 | 0.47193462 | -0.28283002 | 0.17640749 | -0.1259724 | 0.29151253 | 0.05364709 | 0.5052228 | -0.14507683 | 0.13835856 | 0.55789457 | 0.05336821 | -0.69130251 | 0.1461798 | ||||||||||||||||||||||||||||
| 684.097 | Deamino-NAD+ [+F(-)] | cpd:C00857 | -0.22428263 | 0.34096546 | -0.2358358 | 0.04486973 | -0.32444076 | 0.23151599 | -0.17675446 | 0.02481629 | 0.38014583 | 0.11307334 | ||||||||||||||||||||||||||||||||||||||||
| 664.096 | Deamino-NAD+ [-H(+)] | cpd:C00857 | -0.21764792 | 0.50080924 | -0.10522231 | 0.1869569 | -0.1212849 | 0.23075931 | -0.1574066 | 0.17027498 | 0.42992395 | 0.08958473 | ||||||||||||||||||||||||||||||||||||||||
| 270.098 | Deoxyadenosine [+F(-)] | cpd:C00559 | -0.22318737 | 0.07403876 | -0.11530661 | 0.03615612 | 0.3505604 | 0.54983915 | -0.89303233 | 0.00418512 | 1.34746733 | 0.13044795 | ||||||||||||||||||||||||||||||||||||||||
| 250.094 | Deoxyadenosine [-H(+)] | cpd:C00559 | 0.3000883 | 0.00309905 | -3.88705332 | 1.0059E-4 | -2.1621302 | 6.7408E-4 | 0.47939904 | 0.00317417 | 0.95887584 | 3.425E-5 | 1.33443202 | 1.3849E-4 | 1.52332637 | 5.9308E-4 | -2.91497887 | 0.04737736 | 0.00717313 | 0.41373502 | 0.90812983 | 0.98952873 | ||||||||||||||||||||||||||||||
| 246.088 | Deoxycytidine [+F(-)] | cpd:C00881 | -0.19519062 | 0.2094452 | -0.23512656 | 6.9339E-4 | -0.12574011 | 0.86539477 | -0.18335477 | 0.00708487 | 0.45043241 | 0.23608738 |
A
B
C
D
E
F
G
H
I
J
K
L
M
N
O
P
Q
R
S
T
U
V
W
X
Y
Z
AA
AB
AC
AD
AE
AF
AG
AH
AI
AJ
AK
AL
AM
AN
AO
AP
AQ
AR
AS
AT
AU
AV
AW
AX
AY
AZ
BA
BB
BC
BD
BE
BF
BG
BH
BI
BJ
BK
BL
BM
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
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32
33
34
35
36
37
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39
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41
42
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45
46
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63
64
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68
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73
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81
82
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100
| # Fold change values for including P-value, not corrected for batch effect | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| f | Tn051_MPN051_5 | Tn051_MPN051_5 | KO51_mutant_6 | KO51_mutant_6 | __ | Tn674_N/A_5 | Tn674_N/A_5 | Tn674_mutant_6 | Tn674_mutant_6 | Tn674_mutant_7 | Tn674_mutant_7 | __ | TF173_mutant_6 | TF173_mutant_6 | TF173_mutant_7 | TF173_mutant_7 | __ | TF178_MPN250_5 | TF178_MPN250_5 | TF178_mutant_7 | TF178_mutant_7 | __ | TF183_mutant_6 | TF183_mutant_6 | __ | TF184_mutant_7 | TF184_mutant_7 | __ | TF187_MPN674_5 | TF187_MPN674_5 | TF187_mutant_7 | TF187_mutant_7 | __ | __ | TF414_mutant_6 | TF414_mutant_6 | __ | TF462_mutant_6 | TF462_mutant_6 | TF462_mutant_7 | TF462_mutant_7 | __ | TF463_mutant_6 | TF463_mutant_6 | TF463_mutant_7 | TF463_mutant_7 | TF413_mutant_7 | TF413_mutant_7 | __ | |||||||||||||||
| Protein KO (KO),overexpressed (TF), or perturbation | Tn051 | Tn051 | KO51 | KO51 | Tn674 | Tn674 | Tn674 | Tn674 | Tn674 | Tn674 | TF173 | TF173 | TF173 | TF173 | TF178 | TF178 | TF178 | TF178 | TF183 | TF183 | TF184 | TF184 | TF187 | TF187 | TF187 | TF187 | TF414 | TF414 | TF462 | TF462 | TF462 | TF462 | TF463 | TF463 | TF463 | TF463 | TF413 | TF413 | ||||||||||||||||||||||||||
| Name of experiment to find the conditions | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| BATCH | 5 | 5 | 6 | 6 | 5 | 5 | 6 | 6 | 7 | 7 | 6 | 6 | 7 | 7 | 5 | 5 | 7 | 7 | 6 | 6 | 7 | 7 | 5 | 5 | 7 | 7 | 6 | 6 | 6 | 6 | 7 | 7 | 6 | 6 | 7 | 7 | 7 | 7 | ||||||||||||||||||||||||||
| GLUCOSE in THE WASH | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||||||||||||||||||||||
| MPN051 | MPN051 | mutant | mutant | N/A | N/A | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | MPN250 | MPN250 | mutant | mutant | mutant | mutant | mutant | mutant | MPN674 | MPN674 | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | |||||||||||||||||||||||||||
| REFERENCE | MEDIAN block 5 | Gent-Cm | Gent-Cm | REF2 block 5 | REF Tns block 6 | REF block 7 | REF2 block 6 | REF block 7 | REF2 block 5 | REF block 7 | REF2 block 6 | REF block 7 | MEDIAN block 5 | REF block 7 | REF2 block 6 | REF2 block 6 | REF block 7 | REF2 block 6 | REF block 7 | REF block 7 | ||||||||||||||||||||||||||||||||||||||||||||
| Protein KO (KO),overexpressed (TF), or perturbation | Tn051 | Tn051 | KOMPN51-gpsA | KOMPN51-gpsA | Tn674 | Tn674 | Tn674 | Tn674 | Tn674 | Tn674 | TF173 | TF173 | TF173 | TF173 | TF178 | TF178 | TF178 | TF178 | TF183 | TF183 | TF184 | TF184 | TF187 | TF187 | TF187 | TF187 | TF414 | TF414 | TF462 | TF462 | TF462 | TF462 | TF463 | TF463 | TF463 | TF463 | TF413 | TF413 | ||||||||||||||||||||||||||
| MPN | MPN051-KO | KOMPN51-gpsA | KOMPN51-gpsA | MPN674-KO | MPN674-KO | MPN674-KO | MPN303 | MPN303 | MPN250 | MPN250 | MPN606 | MPN627 | MPN674 | MPN674 | MPN430 | MPN025 | MPN025 | MPN302 | MPN302 | MPN051 | ||||||||||||||||||||||||||||||||||||||||||||
| Enzyme | GlpD | GlpD/GpsA | Ldh | Ldh | Ldh | pyk | pyk | pgiB | pgiB | eno | ptsI | ldh | ldh | ldh | ldh | gap | gap | tsr | tsr | tsr | tsr | pfk | pfk | pfk | pfk | GlpD | GlpD | |||||||||||||||||||||||||||||||||||||
| mRNA fold | NA | NA | NA | NA | NA | 1.291214505 | 1.291214505 | 1.4085032795 | 1.4085032795 | 0.549999999999999 | 1.7384333675 | 1.26939831 | 1.26939831 | 0.27 | 0.48 | 0.48 | 3.4236509485 | 3.4236509485 | 4.03464644 | |||||||||||||||||||||||||||||||||||||||||||||
| Protein fold | NA | NA | NA | NA | NA | ND | ND | 0.805 | 0.805 | 0.41499999999999904 | 1.425 | 0.4 | 0.4 | ND | ND | ND | ND | ND | ND | |||||||||||||||||||||||||||||||||||||||||||||
| Protein (estimation) | 1.2639698789445 | 1.2639698789445 | 0.264303 | 0.46987199999999996 | 0.46987199999999996 | 3.35141191348665 | 3.35141191348665 | 3.949515400116 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Tn051 | Tn051 | KO51 | KO51 | Tn674 | Tn674 | Tn674 | Tn674 | Tn674 | Tn674 | TF173 | TF173 | TF173 | TF173 | TF178 | TF178 | TF178 | TF178 | TF183 | TF183 | TF184 | TF184 | TF187 | TF187 | TF187 | TF187 | TF414 | TF414 | TF462 | TF462 | TF462 | TF462 | TF463 | TF463 | TF463 | TF463 | TF413 | TF413 | |||||||||||||||||||||||||||
| m/z | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | metabolite | KEGG ID | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | fold | p-value | ||||||||||||
| 59.015 | Acetate [-H(+)] | cpd:C00033 | 0.23581002 | 0.41640352 | -0.29773791 | 0.49662622 | 0.73675355 | 0.29683334 | -0.47618216 | 0.00178908 | 0.01499603 | 0.19027661 | 0.6207101 | -0.10159866 | 0.35985527 | 0.56329858 | 0.66661983 | -0.02119126 | 0.92431988 | 0.0758533 | 0.62348882 | 0.07390864 | 0.0741626 | 0.237486 | 0.25423779 | 0.32968947 | 0.01842743 | -0.2554397 | 0.61972678 | -0.15142072 | 0.44889669 | -0.09967462 | 0.78853958 | -0.23555429 | 0.0366982 | 0.81784305 | -0.38100331 | 0.73947692 | ||||||||||||||||||||||||||
| 492.163 | 10-Formyltetrahydrofolate [+F(-)] | cpd:C00234 | Folinic acid [+F(-)] | cpd:C03479 | -0.2673682 | 0.42024581 | -0.41088063 | 0.02515179 | 0.09998887 | 0.89832401 | 0.41702269 | 0.33821557 | 0.29006328 | 0.04314 | 0.34798334 | 0.12866657 | -0.06363267 | 0.3169569 | -0.45103253 | 0.45835574 | ||||||||||||||||||||||||||||||||||||||||||||
| 472.154 | 10-Formyltetrahydrofolate [-H(+)] | cpd:C00234 | Folinic acid [-H(+)] | cpd:C03479 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 213.015 | 2-Deoxy-D-ribose 1-phosphate [-H(+)] | cpd:C00672 | 2-Deoxy-D-ribose 5-phosphate [-H(+)] | cpd:C00673 | 0.53702621 | 7.0092E-4 | 0.15733329 | 0.45626211 | -0.03619493 | 0.84959752 | -0.03745273 | 0.90815414 | -0.11349378 | 0.95170519 | 0.08348127 | 0.18999865 | -0.09324667 | 0.2102995 | -0.02913349 | 0.70660138 | -0.03721707 | 0.4075019 | -0.05543381 | 0.06554487 | -0.02048918 | 0.59693225 | 0.10296159 | 0.2206738 | -0.10866144 | 0.81084955 | -0.1524141 | 0.22664421 | 0.1778617 | 0.17653083 | 0.1401994 | 0.90764148 | 0.08427839 | 0.62568268 | 0.09060774 | 0.60435784 | -0.11274815 | 0.69340057 | ||||||||||||||||||||||
| 273.005 | 3-Dehydro-L-gulonate 6-phosphate [-H(+)] | cpd:C14899 | 0.00736263 | 0.47252253 | 0.17668089 | 0.44049266 | 0.08170352 | 0.2992982 | -0.3261869 | 0.00609695 | 0.08819286 | 0.96189856 | -0.13294872 | 0.5593425 | 0.11300727 | 0.14565454 | 0.51766997 | 0.3054867 | 0.0483941 | 0.24499854 | 0.10387924 | 0.81069493 | 0.05583841 | 0.71258937 | -0.10751494 | 0.19942551 | ||||||||||||||||||||||||||||||||||||||
| 184.988 | 3-Phospho-D-glycerate [-H(+)] | cpd:C00197 | 2-Phospho-D-glycerate [-H(+)] | cpd:C00631 | -0.43297872 | 0.02021687 | -0.43047644 | 0.0031279 | 0.24291502 | 0.53279774 | -0.2313274 | 0.31828648 | -0.22610374 | 0.17797278 | -0.0470525 | 0.92898944 | -0.20281063 | 0.2552943 | 0.52636616 | 0.3935115 | 0.07387765 | 0.74805823 | 0.49513185 | 0.12974594 | 0.18742752 | 0.10830089 | 0.09163495 | 0.13525588 | 0.20456731 | 0.0794484 | -0.09024961 | 0.87286771 | -0.27498081 | 0.32069461 | 0.02306016 | 0.91583034 | -0.24551619 | 0.1929436 | 0.09878254 | 0.50761689 | -0.1661778 | 0.83255983 | ||||||||||||||||||||||
| 284.96 | 3-Phospho-D-glyceroyl phosphate [+F(-)] | cpd:C00236 | -0.00656714 | 0.54540066 | 0.19843957 | 0.33596728 | 0.17274754 | 0.8949165 | 0.147635 | 0.14848519 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 264.95 | 3-Phospho-D-glyceroyl phosphate [-H(+)] | cpd:C00236 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 475.163 | 5,10-Methenyltetrahydrofolate [+F(-)] | cpd:C00445 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 455.159 | 5,10-Methenyltetrahydrofolate [-H(+)] | cpd:C00445 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 476.167 | 5,10-Methylenetetrahydrofolate [+F(-)] | cpd:C00143 | -0.10586689 | 0.00842343 | 0.09823414 | 0.82908489 | 0.0705616 | 0.55151101 | -0.06065111 | 0.95074306 | 0.12301442 | 8.441E-5 | -0.0776767 | 0.75543416 | -0.09639581 | 0.00262468 | 0.02845556 | 0.73497829 | -0.14744116 | 0.14887497 | -0.06565114 | 0.01428798 | 0.10417396 | 0.23639307 | ||||||||||||||||||||||||||||||||||||||||
| 408.947 | 5-Phospho-alpha-D-ribose 1-diphosphate [+F(-)] | cpd:C00119 | 0.28564545 | 0.01492919 | -0.09474935 | 0.16377637 | -0.01922826 | 0.53750234 | 0.37997671 | 0.01112377 | 0.34798502 | 0.00360444 | -0.08431992 | 0.32699956 | -0.04714348 | 0.73337339 | 0.12066545 | 0.84378387 | ||||||||||||||||||||||||||||||||||||||||||||||
| 388.945 | 5-Phospho-alpha-D-ribose 1-diphosphate [-H(+)] | cpd:C00119 | 0.20932988 | 0.11064333 | -0.14751102 | 0.67225373 | -0.62698825 | 0.26933632 | 0.67166149 | 0.50852134 | 0.79949609 | -0.12291789 | 0.13964457 | -0.31240642 | 0.32594736 | -0.03671582 | 0.92980607 | -0.1212298 | 0.81149504 | -0.25047171 | 0.49004039 | -0.36295082 | 0.58668713 | 0.45017732 | 0.00477433 | |||||||||||||||||||||||||||||||||||||||
| 138.98 | Acetyl phosphate [-H(+)] | cpd:C00227 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 808.118 | Acetyl-CoA [-H(+)] | cpd:C00024 | 0.32095366 | 0.20123325 | -0.18857621 | 0.75920526 | -0.33064321 | 0.512 | -0.08337486 | 0.48544258 | 1.43267267 | 0.61528112 | -0.21780381 | 0.00223582 | -0.23104131 | 0.00187403 | -0.15491949 | 0.67487258 | 0.06745301 | 0.91285423 | -0.1599907 | 0.39246123 | 0.25427828 | 0.30728671 | 0.28093675 | 0.00832421 | ||||||||||||||||||||||||||||||||||||||
| 154.052 | Adenine [+F(-)] | cpd:C00147 | 0.12102381 | 0.91694771 | 0.02529606 | 0.75095258 | -0.49353754 | 0.2210397 | -0.45375639 | 0.0377346 | 0.07357329 | 0.32805863 | 0.17893109 | 0.89546774 | 0.32191466 | 0.37749663 | 0.07809487 | 0.59458684 | 0.487122 | 0.01743346 | 0.27569148 | 0.2254846 | -0.36917748 | 0.16302271 | -0.84038406 | 0.40051752 | ||||||||||||||||||||||||||||||||||||||
| 134.047 | Adenine [-H(+)] | cpd:C00147 | -0.17037584 | 0.07636334 | -0.16155049 | 0.11631406 | -0.10765381 | 0.65665933 | 0.06079844 | 0.01743868 | -0.23730124 | 0.11775909 | 0.04854646 | 0.93610649 | 0.07102588 | 0.37531843 | -0.03472282 | 0.25535078 | -0.02229037 | 0.76791611 | 0.05484839 | 0.59991651 | -0.1049447 | 0.12250322 | 0.06357375 | 0.95490146 | -0.11034291 | 0.02204299 | -0.02397598 | 0.11034463 | 0.51451585 | -0.06762864 | 0.0340999 | -0.00860511 | 0.42410677 | 0.03466536 | 0.12980697 | 0.18070756 | 0.37219594 | |||||||||||||||||||||||||
| 286.094 | Adenosine [+F(-)] | cpd:C00212 | Deoxyguanosine [+F(-)] | cpd:C00330 | -0.22398276 | 0.40593273 | -0.29607547 | 0.1210199 | -0.12227757 | 0.61124121 | -0.19943457 | 0.04924878 | 0.01046662 | 0.49070807 | -0.09372308 | 0.5329429 | 0.04066107 | 0.25353057 | -0.22534373 | 0.64992314 | -0.07299128 | 0.89352353 | -0.12963621 | 0.0132248 | -0.10463895 | 0.56170146 | -0.0280117 | 0.23751956 | 0.08035644 | 0.17759329 | -0.03011196 | 0.74197451 | -0.09687279 | 0.32971881 | -0.06760414 | 0.56659386 | 0.15595962 | 0.40025187 | -0.14516552 | 0.85388157 | 0.27910709 | 0.42310798 | ||||||||||||||||||||||
| 266.089 | Adenosine [-H(+)] | cpd:C00212 | Deoxyguanosine [-H(+)] | cpd:C00330 | -0.21608464 | 0.50327771 | 0.01224731 | 0.54366596 | 0.02867212 | 0.32527959 | 0.12941489 | 0.58338462 | ||||||||||||||||||||||||||||||||||||||||||||||||||||
| 426.022 | ADP [-H(+)] | cpd:C00008 | Adenosine 3',5'-bisphosphate [-H(+)] | cpd:C00054 | dGDP [-H(+)] | cpd:C00361 | -0.19213511 | 0.26387765 | -0.19053821 | 0.32886408 | -0.22334311 | 0.67239652 | 0.58351 | 0.02133439 | -0.5489862 | 0.00800737 | -2.6869E-4 | 0.84532467 | -0.00757718 | 0.6747912 | 0.74549008 | 0.61931927 | -0.13978519 | 0.64896101 | 0.31334679 | 0.19894846 | -0.22192101 | 0.35372517 | 0.03544897 | 0.54503543 | 0.13814346 | 0.70809947 | 0.17508303 | 0.95957482 | -0.6650666 | 0.05709002 | -0.07035959 | 0.61821472 | -0.13508699 | 0.48430644 | 0.27579455 | 0.90104756 | 0.40617042 | 0.10325648 | ||||||||||||||||||||
| 346.057 | AMP [-H(+)] | cpd:C00020 | dGMP [-H(+)] | cpd:C00362 | 0.09987918 | 0.83569385 | -0.12651215 | 0.54876813 | -0.40177767 | 0.08034626 | 0.28014732 | 0.00222385 | -0.19521304 | 0.0645238 | 0.43031599 | 0.02476283 | -0.0347106 | 0.40097835 | -0.10126005 | 0.51054701 | -0.11294863 | 0.85790112 | 0.26926079 | 0.43705604 | -0.0774091 | 0.98441544 | -0.45007015 | 0.05016972 | 0.27201873 | 0.02787769 | 0.22769333 | 0.34078095 | -0.08876503 | 0.23841732 | 0.08915777 | 0.69092625 | 0.02112347 | 0.32733915 | -0.05432412 | 0.73757988 | 0.12737372 | 0.28651064 | ||||||||||||||||||||||
| 195.029 | Ascorbate [+F(-)] | cpd:C00072 | 0.09405984 | 0.44648249 | -0.29101585 | 0.19196284 | 0.19372711 | 0.39702472 | -0.27812141 | 0.00206128 | -0.05189763 | 0.47104286 | 3.2401E-4 | 0.81360234 | -0.25578248 | 0.05817991 | 0.23373209 | 0.84070907 | 0.07208429 | 0.52240542 | 0.03684804 | 0.85579378 | 0.24143135 | 0.01265039 | 0.04056246 | 0.81629084 | 0.32075409 | 0.00306117 | -0.24431246 | 0.52085897 | -0.02515768 | 0.66558566 | 0.12317386 | 0.83182097 | -0.1126364 | 0.31768897 | -0.10083509 | 0.76765932 | 0.06933806 | 0.76409927 | ||||||||||||||||||||||||
| 175.026 | Ascorbate [-H(+)] | cpd:C00072 | 0.35442923 | 0.09833873 | -0.13379363 | 0.32822921 | 0.20013003 | 0.03439038 | -0.2289369 | 0.01591348 | 0.0996626 | 0.38280539 | 0.25392027 | 0.07674925 | -0.52122018 | 0.00215432 | 0.00426952 | 0.35096973 | -0.18789273 | 0.2715647 | 0.10198084 | 0.12580753 | 0.16767472 | 0.24291889 | 0.12022397 | 0.54119315 | 0.0094516 | 0.41753472 | -0.19265658 | 0.09299808 | -0.01829859 | 0.79282991 | -0.03273644 | 0.56510643 | -0.00427201 | 0.64359093 | 0.42857973 | 0.39189773 | 0.16655471 | 0.49544738 | ||||||||||||||||||||||||
| 525.996 | ATP [+F(-)] | cpd:C00002 | dGTP [+F(-)] | cpd:C00286 | 0.02963408 | 0.34457848 | -0.14111059 | 0.05252539 | -0.14535112 | 0.20943171 | 0.0613915 | 0.46681848 | -0.00709231 | 0.66563256 | 0.10839199 | 0.59870953 | 0.12276907 | 0.17101934 | 0.24755139 | 0.22971113 | ||||||||||||||||||||||||||||||||||||||||||||
| 505.991 | ATP [-H(+)] | cpd:C00002 | dGTP [-H(+)] | cpd:C00286 | -0.32752489 | 0.09586093 | -0.91547545 | 0.09010969 | -0.56988696 | 0.38736298 | 0.42496673 | 0.0019612 | -0.20001051 | 0.899 | -0.27790994 | 0.97919564 | 0.06755107 | 0.5010519 | 0.04256925 | 0.78693885 | -0.1416412 | 0.28069376 | 0.37662712 | 0.00472696 | -0.29316707 | 0.02227029 | -0.41447265 | 0.13048998 | -0.01079471 | 0.91983648 | 0.50043753 | 0.3445483 | -0.34739021 | 0.53289906 | -0.04036575 | 0.46952153 | -0.2604515 | 0.58586981 | 0.03993269 | 0.84385859 | 0.23286174 | 0.09441112 | ||||||||||||||||||||||
| 159.977 | Carbamoyl phosphate [+F(-)] | cpd:C00169 | -0.27261337 | 0.35787177 | -0.37299464 | 0.02617645 | 0.29163802 | 0.91422967 | -0.36936129 | 0.02506834 | -0.14373923 | 0.83646944 | 0.15114475 | 0.17290337 | -0.32939125 | 0.0746441 | -0.02689015 | 0.97244526 | -0.06086555 | 0.66224484 | 0.0271191 | 0.83752885 | 0.00580022 | 0.61826865 | 1.29705735 | 0.52367375 | 0.02935625 | 0.91630085 | 0.03310979 | 0.88902337 | -0.2333819 | 0.68812929 | -0.09747846 | 0.78978455 | -0.29228731 | 0.11315498 | 0.1780489 | 0.46154406 | -0.07388983 | 0.55673557 | ||||||||||||||||||||||||
| 139.975 | Carbamoyl phosphate [-H(+)] | cpd:C00169 | 0.17469829 | 0.12813254 | 0.43075059 | 0.16447345 | -0.22693642 | 0.39872829 | -0.12260297 | 0.20946088 | 0.23763895 | 0.97753246 | 0.09515481 | 0.69734762 | 0.93333138 | -0.02046639 | 0.34826042 | 0.14063836 | 0.77768469 | -0.0811366 | 0.47374908 | 0.11760594 | 0.71021701 | 0.06690808 | 0.54344845 | |||||||||||||||||||||||||||||||||||||||
| 402.011 | CDP [-H(+)] | cpd:C00112 | -0.43751003 | 0.10469651 | -0.26405173 | 0.12381725 | -0.41655141 | 0.76302871 | 0.32081932 | 0.09714487 | -0.49209532 | 0.00267162 | 0.15707747 | 0.26360627 | -0.0455534 | 0.66004307 | 0.41756396 | 0.91409748 | -0.09876175 | 0.43863444 | 0.26674133 | 0.2660769 | -0.43427139 | 0.07019345 | -0.18643353 | 0.19391625 | 0.97352689 | 0.17836977 | 0.76895612 | -0.31642388 | 0.22688031 | -0.14102688 | 0.36192812 | 0.00588151 | 0.62578326 | 0.15565663 | 0.96788518 | 0.59818733 | 0.00570805 | |||||||||||||||||||||||||
| 507.102 | CDP-choline [+F(-)] | cpd:C00307 | -0.06589141 | 0.35969136 | 0.21573489 | 0.24783744 | 0.04529996 | 0.52752846 | 0.23186049 | 0.11303858 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 487.1 | CDP-choline [-H(+)] | cpd:C00307 | -0.11504174 | 0.08390496 | 4.8366E-4 | 0.94763999 | 0.05743573 | 0.25310844 | 0.08559944 | 0.65386724 | 0.0522201 | 0.46687256 | -0.11016361 | 0.13909787 | -0.11199239 | 0.17914185 | 0.16677508 | 0.58807455 | 0.14098447 | 0.64671884 | -0.1354563 | 0.02735748 | 0.42664938 | 0.02817373 | 0.09323103 | 0.42153595 | 0.52417363 | 0.00135544 | 0.12913597 | 0.31867041 | 0.00128814 | 0.2270145 | 0.07484977 | 0.45403771 | 0.00338405 | 0.62540099 | 0.63275476 | -0.42755157 | 0.65693708 | |||||||||||||||||||||||||
| 203.068 | Choline phosphate [+F(-)] | cpd:C00588 | 0.05939753 | 0.80751166 | -0.10699731 | 0.460824 | 0.10527706 | 0.13426479 | -0.14671693 | 0.53549179 | -0.08881931 | 0.51614547 | -0.0581763 | 0.3957882 | -0.12753262 | 0.50145517 | -0.26196967 | 0.16438657 | -0.45038209 | 0.11434232 | 0.00519088 | 0.81302387 | 0.21564269 | 0.00759979 | 0.29358975 | 0.60109355 | ||||||||||||||||||||||||||||||||||||||
| 183.067 | Choline phosphate [-H(+)] | cpd:C00588 | -0.26443651 | 0.78823488 | -0.31063056 | 0.03156427 | -0.01209657 | 0.81707699 | -0.09710931 | 0.78638459 | -0.00492011 | 0.80465644 | -0.10557939 | 0.56233888 | -0.2067214 | 0.98775642 | -0.29537403 | 0.30216492 | ||||||||||||||||||||||||||||||||||||||||||||||
| 342.05 | CMP [+F(-)] | cpd:C00055 | -0.14447265 | 0.08607401 | -0.11938013 | 0.21451687 | 0.03660306 | 0.65060357 | 0.19186365 | 0.00245425 | -0.16721366 | 0.36224477 | 0.01324769 | 0.51892687 | -0.1594996 | 0.11566565 | ||||||||||||||||||||||||||||||||||||||||||||||||
| 322.045 | CMP [-H(+)] | cpd:C00055 | 0.00796311 | 0.89388088 | -0.08929141 | 0.15938054 | -0.11417084 | 0.55268495 | 0.08049741 | 0.34935864 | -0.0773 | 0.41490053 | 0.09054346 | 0.02858274 | -0.12394027 | 3.963E-4 | -0.15394308 | 0.36687446 | -0.11690307 | 0.17702286 | 0.11812015 | 0.48023066 | -0.04647897 | 0.18099722 | -0.18762561 | 0.14311513 | 0.01503899 | 0.03583523 | -0.13545785 | 0.19422336 | -0.01567211 | 0.14885595 | -0.17748685 | 0.28525851 | 0.04694549 | 0.40658738 | 0.18143441 | 0.29464674 | 0.1400189 | 0.03009209 | ||||||||||||||||||||||||
| 766.11 | CoA [-H(+)] | cpd:C00010 | 0.1383891 | 0.61997575 | 0.61137492 | 0.61303351 | -0.15458193 | 0.0646 | -0.00467979 | 0.29778411 | 1.18236615 | 0.40698347 | 0.25786313 | 0.78549602 | 0.25960119 | 0.42799711 | 0.32744685 | 0.41241156 | 0.47797501 | 0.00796682 | 0.3012939 | 0.89973483 | -0.05140918 | 0.59006847 | -0.20118884 | 0.91205637 | ||||||||||||||||||||||||||||||||||||||
| 501.978 | CTP [+F(-)] | cpd:C00063 | -0.11466519 | 0.71010108 | -0.12361275 | 0.02035797 | -0.04568372 | 0.39370389 | -0.05145305 | 0.14517778 | -0.02135552 | 0.86196941 | 0.06955634 | 0.99883179 | 0.21741336 | 0.39745583 | 0.30619977 | 0.00267388 | ||||||||||||||||||||||||||||||||||||||||||||||
| 481.978 | CTP [-H(+)] | cpd:C00063 | -0.19482724 | 0.03581253 | -0.00576559 | 0.78788198 | -0.12549065 | 0.73521536 | -0.37007321 | 0.04284107 | -0.18836877 | 0.4043294 | -0.10258245 | 0.31971892 | -0.01037454 | 0.58002354 | -0.18834965 | 0.46670225 | -0.03841977 | 0.52818719 | 0.00923252 | 0.48410597 | 0.17764349 | 0.76796221 | 0.2272729 | 0.0644839 | ||||||||||||||||||||||||||||||||||||||
| 677.1 | Cyclic di-3',5'-adenylate [+F(-)] | cpd:C20565 | -0.27689439 | 0.03690527 | 0.11910381 | 0.58043967 | -0.16467146 | 0.33312882 | -0.25222654 | 0.09457454 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 657.094 | Cyclic di-3',5'-adenylate [-H(+)] | cpd:C20565 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 242.079 | Cytidine [-H(+)] | cpd:C00475 | -0.04968551 | 0.61755094 | -0.02088479 | 0.50165178 | -0.11422836 | 0.17584324 | 0.00559689 | 0.82408533 | -0.2786805 | 0.07753499 | 0.03478804 | 0.48783338 | -0.02505155 | 0.83037568 | -0.08626096 | 0.71775072 | 0.12859781 | 0.06561273 | -0.35348061 | 0.08796422 | 0.09484342 | 0.08309079 | 0.03738008 | 0.88595688 | 0.17901432 | 0.00111621 | -0.11222505 | 0.31294805 | 0.02501098 | 0.87096527 | -0.07976139 | 0.80537704 | 0.11062394 | 0.0053409 | -0.05070789 | 0.26152112 | 0.02645456 | 0.85256754 | ||||||||||||||||||||||||
| 430.036 | dADP [+F(-)] | cpd:C00206 | -0.26913123 | 0.19747421 | -0.14388703 | 0.33443723 | 0.16409823 | 0.68176735 | 0.02550267 | 0.60449692 | 0.01651191 | 0.91600553 | -0.20799551 | 0.64918993 | -0.07255004 | 0.54675057 | ||||||||||||||||||||||||||||||||||||||||||||||||
| 410.027 | dADP [-H(+)] | cpd:C00206 | -0.47615302 | 0.06983397 | -0.03000563 | 0.55718219 | -0.19686626 | 0.48569883 | 0.00347637 | 0.5844888 | -0.79598446 | 0.0013021 | 0.139878 | 0.41954859 | -0.18101315 | 0.35250978 | 1.00803195 | 0.44842232 | -0.20131612 | 0.03266586 | 0.38092673 | 0.23290037 | 0.10301692 | 0.81826476 | -0.0772725 | 0.33340912 | 0.26660961 | 0.08665949 | -0.17965941 | 0.83435439 | -0.37559006 | 0.07958244 | -0.1269785 | 0.45455123 | -0.11943333 | 0.2695072 | -0.00186901 | 0.98136182 | 0.49520243 | 0.03091113 | ||||||||||||||||||||||||
| 330.062 | dAMP [-H(+)] | cpd:C00360 | 0.26824014 | 0.28811849 | -0.13584627 | 0.18650392 | -0.03227732 | 0.98800901 | 0.05611864 | 0.6871962 | -0.39415781 | 0.07633666 | 0.12792076 | 0.93013212 | -0.15471249 | 0.07798323 | -0.02318838 | 0.94635704 | -0.27638308 | 0.0901069 | 0.54201279 | 0.21258869 | 0.16818099 | 0.17677312 | -0.23432898 | 0.25407055 | 0.64211769 | 0.00236593 | 0.08182419 | 0.32501319 | -0.39569561 | 0.32164184 | -0.04326313 | 0.97755377 | -0.09608203 | 0.16249422 | -0.03226352 | 0.87041256 | 0.54581428 | |||||||||||||||||||||||||
| 510.004 | dATP [+F(-)] | cpd:C00131 | 0.07745727 | 0.65860321 | -0.18523482 | 0.0460169 | -0.06789135 | 0.77128027 | 0.22134703 | 0.02119122 | 0.12936736 | 0.38864949 | 0.08483961 | 0.18316091 | 0.11434798 | 0.82241166 | -0.02991972 | 0.74821185 | ||||||||||||||||||||||||||||||||||||||||||||||
| 489.993 | dATP [-H(+)] | cpd:C00131 | -0.21516313 | 0.2499394 | -0.03316452 | 0.73738009 | -0.33610498 | 0.10116172 | -0.06334514 | 0.4606165 | 0.78385011 | 0.60418959 | -0.11032737 | 0.49438975 | -0.27823734 | 0.4443486 | -0.13745584 | 0.61567559 | -0.03644778 | 0.77400025 | -0.01593557 | 0.63349005 | 0.05941623 | 0.82315323 | 0.32801606 | 0.22920384 | ||||||||||||||||||||||||||||||||||||||
| 406.017 | dCDP [+F(-)] | cpd:C00705 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| 386.016 | dCDP [-H(+)] | cpd:C00705 | -0.46644373 | 0.05298001 | -0.23945103 | 0.04417909 | -0.22907971 | 0.69190407 | 0.14986206 | 0.28069713 | -0.84912643 | 0.00252 | -0.01226472 | 0.95163893 | -0.27733269 | 0.25706071 | 0.7654926 | 0.43170771 | -0.27837623 | 0.00284275 | 0.24757497 | 0.05807338 | -0.0386271 | 0.92916923 | -0.03474641 | 0.70081818 | 0.18331895 | 0.05244857 | 0.14739959 | 0.77331014 | -0.40855233 | 0.32867702 | -0.0075881 | 0.62606691 | -0.05779645 | 0.86506643 | 0.12842191 | 0.7167092 | 0.49024872 | 7.097E-5 | ||||||||||||||||||||||||
| 326.059 | dCMP [+F(-)] | cpd:C00239 | -0.0389839 | 0.58392313 | -0.07698109 | 0.22231792 | 0.02674263 | 0.68941073 | 0.15023841 | 0.01076334 | 0.13549186 | 0.0113214 | 0.1046092 | 0.10924754 | 0.04571312 | 0.95254477 | -0.05780534 | 0.82901161 | ||||||||||||||||||||||||||||||||||||||||||||||
| 306.049 | dCMP [-H(+)] | cpd:C00239 | 0.07971409 | 0.52699009 | -0.36377933 | 0.01430897 | 0.11755902 | 0.25689445 | -0.01800839 | 0.81226118 | -0.04063109 | 0.6394666 | 0.01781805 | 0.30240109 | -0.33991584 | 0.01025288 | 0.02421935 | 0.87401414 | -0.20438706 | 0.09913363 | 0.17940779 | 0.42585937 | 0.24734658 | 0.10525101 | -0.0679155 | 0.10302716 | 0.31028861 | 0.00113752 | -0.04521677 | 0.84166274 | -0.08459194 | 0.44760583 | 0.1213509 | 0.93334291 | -0.24871018 | 0.04015199 | 0.9895265 | -0.13850654 | 0.83906838 | |||||||||||||||||||||||||
| 465.981 | dCTP [-H(+)] | cpd:C00458 | -0.05398121 | 0.21766899 | 0.03539659 | 0.65429459 | -0.20277349 | 0.78834763 | -0.22725941 | 0.09156458 | 0.27646842 | 0.58613103 | -0.11909668 | 0.71441889 | -0.09121503 | 0.1347153 | -0.07771849 | 0.20507815 | 0.06898357 | 0.3445615 | 0.10571373 | 0.86963117 | 0.08033033 | 0.74556285 | 0.15637682 | 0.17651363 | ||||||||||||||||||||||||||||||||||||||
| 684.097 | Deamino-NAD+ [+F(-)] | cpd:C00857 | 0.01356927 | 0.67334734 | -0.27934153 | 0.05278858 | -0.27584212 | 0.03719707 | -0.03213205 | 0.71206579 | 0.11350646 | 0.19448672 | 0.11023537 | 0.59719701 | -0.05756975 | 0.91124527 | 0.07145314999999999 | 0.35451861 |
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AL
AM
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AU
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| # Fold change values corrected per batch, below absolute values based on 24h reference, used as input for automated SS simulations using sampling | ||||||||||||||||||||||||||||||||||||||||||||||||
| SampleID | WT_WT_5 | blank_control_7 | WT_perturbation_7 | water_control_7 | TF173_MPN303_5 | TF178_MPN250_5 | TF187_MPN674_5 | Tn051_MPN051_5 | Tn674_N/A_5 | dLDH,NoxE_N/A_5 | KO51_mutant_6 | TF173_mutant_6 | TF183_mutant_6 | TF414_mutant_6 | TF462_mutant_6 | TF463_mutant_6 | Tn674_mutant_6 | TF173_mutant_7 | TF178_mutant_7 | TF184_mutant_7 | Tn674_mutant_7 | TF413_mutant_7 | TF462_mutant_7 | TF463_mutant_7 | TF187_mutant_7 | Tn051_Gly_perturbation_7 | AA_perturbation_6 | Fe_perturbation_6 | Glu_perturbation_6 | Gly_perturbation_6 | Ox_perturbation_6 | Gly_ctrl_perturbation_7 | WT_noGluc_perturbation_7 | 6h_timecourse_4 | 24h_timecourse_4 | 48h_timecourse_4 | M129_timecourse_6h_3 | M129_timecourse_24h_3 | M129_timecourse_48h_3 | M129_timecourse_96h_3 | ||||||||
| Batch | 7 | 7 | 7 | 7 | 5 | 5 | 5 | 5 | 5 | 5 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 6 | 6 | 6 | 6 | 6 | 7 | 7 | 4 | 4 | 4 | 3 | 3 | 3 | 3 | ||||||||
| Washed | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||||
| Description | WT_WT_5 | blank_control_7 | WT_perturbation_7 | water_control_7 | MPN303-OE_5 | MPN250-OE_5 | MPN674-OE_5 | MPN051-KO_5 | MPN674-KO_5 | MPN674-KO, NoxE OE_5 | MPN674-KO, NoxE OE_6 | MPN303-OE_6 | MPN606-OE_6 | MPN430-OE_6 | MPN025-OE_6 | MPN302-OE_6 | MPN674-KO_6 | MPN303-OE_7 | MPN250-OE_7 | MPN627-OE_7 | MPN674-OE_7 | MPN051-OE_7 | MPN025-OE_7 | MPN302-OE_7 | MPN674-OE_7 | Tn051_Gly_perturbation_7 | AA_perturbation_6 | Fe_perturbation_6 | Glu_perturbation_6 | Gly_perturbation_6 | Ox_perturbation_6 | Gly_ctrl_perturbation_7 | WT_noGluc_perturbation_7 | 6h_timecourse_4 | 24h_timecourse_4 | 48h_timecourse_4 | M129_timecourse_6h_3 | M129_timecourse_24h_3 | M129_timecourse_48h_3 | M129_timecourse_96h_3 | ||||||||
| Growth conditions | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), aerated | adherent (attached to the bottom of the flask), aerated | adherent (attached to the bottom of the flask), aerated | adherent (attached to the bottom of the flask), aerated | ||||||||
| Time | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 6 | 24 | 48 | 6 | 24 | 48 | 96 | ||||||||
| ExperimentType | control | control | control | control | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant, perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | timecourse | timecourse | timecourse | timecourse, perturbation | timecourse, perturbation | timecourse, perturbation | timecourse, perturbation | ||||||||
| Genes | 0 | 0 | 0 | 0 | pyk | pgi | ldh | glpD | ldh | 0 | 0 | pyk | eno | gap | tsr | pfkA | ldh | pyk | pgi | ptsI | ldh | glpD | tsr | pfkA | ldh | glpD | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||||
| Est. FC | 0 | 0 | 0 | 0 | 1.291214505 | 1.4085032795 | 1.26939831 | NA | 0 | 0 | 1 | 1.291214505 | 0.549999999999999 | 0.27 | 0.48 | 3.4236509485 | 0 | 1.291214505 | 1.4085032795 | 1.7384333675 | 1.26939831 | 4.03464644 | 0.48 | 3.4236509485 | 1.26939831 | NA | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||||
| Effected par | 0 | 0 | 0 | 0 | re07_PYK | re02_PGI | re08_LDH | glpD | re08_LDH | re08_LDH | re08_LDH | re07_PYK | re06_ENO | re06_ENO | re04_FBA | re03_PFK | re08_LDH | re07_PYK | re02_PGI | ptsI | re08_LDH | glpD | re04_FBA | re03_PFK | re08_LDH | glpD | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||||
| KEGG ID DATA | KEGG ID Model | Metabolite | ParNewValue | 0:0 | 0:0 | 0:0 | 0:0 | re07_PYK:1.291214505 | re02_PGI:1.4085032795 | re08_LDH:1.26939831 | glpD:NA | re08_LDH:0 | re08_LDH:0 | re08_LDH:1 | re07_PYK:1.291214505 | re06_ENO:0.549999999999999 | re06_ENO:0.27 | re04_FBA:0.48 | re03_PFK:3.4236509485 | re08_LDH:0 | re07_PYK:1.291214505 | re02_PGI:1.4085032795 | ptsI:1.7384333675 | re08_LDH:1.26939831 | glpD:4.03464644 | re04_FBA:0.48 | re03_PFK:3.4236509485 | re08_LDH:1.26939831 | glpD:NA | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | |||||||||||
| cpd:C00024 | cpd:C00024 | AcCoA | Acetyl-CoA [-H(+)] | 0.01438149983680856 | 1.2932764123507288 | 0.6207885632176188 | 0.9910540948277134 | 0.7785713846071283 | 1.2086147607210296 | 0.0925548890778091 | 0.9289083862837766 | 1.2479741074109967 | 0.431905925170014 | 0.9353816570168844 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.96403282971864 | 0.8833221942425261 | 0.9126591175776485 | 0.9531165383911537 | 1.2923917688596351 | 0.9547712955202295 | 1.2444354448562391 | 1.0442838458343402 | 1.0777036637171273 | 1 | 1 | 1 | 1 | 1 | 0.8552478172870004 | 0.8865258685757404 | 1 | 1 | 1 | 1.0850155596643312 | 1.2344801499914133 | 1.5473222955946508 | 1.2810564162389897 | ||||
| cpd:C00033 | cpd:C00033 | ACE | Acetate [-H(+)] | 0.87378 | 1.2380674908668747 | 1.154952918276792 | 1.1431397707801667 | 0.8899824227431168 | 1.1457843328906872 | 0.7845822707880752 | 1.0750704080567381 | 1.0510079074411252 | 0.9318137735433951 | 0.9359332458747276 | 0.7937564770008588 | 1.0729652389738658 | 1.0973358666007702 | 0.9697431103555777 | 0.9607452995824489 | 0.9195223241493222 | 0.833589863843349 | 0.9673732150584232 | 1.0268935132679728 | 1.1155317582130444 | 1.0945056565246152 | 0.9709196779470484 | 1.0074737667335838 | 1.0933095402184903 | 1.2716099467556208 | 0.8553547463253761 | 0.9113795810145321 | 0.852551503357438 | 0.6798857787829208 | 1.0449705553605604 | 1.1016810572099287 | 0.981959434640156 | 0.4671331686436608 | 1.1450515023070658 | 0.9561460140375926 | 0.7518169456012357 | 0.41391304742582036 | 0.5688158946859657 | 0.37885482151304395 | 0.32973165794624637 | ||||
| cpd:C00008 | cpd:C00008 | ADP | ADP [-H(+)] | 0.5230327376535936 | 1.5325047635247278 | 0.1376030380922717 | 1.126969343527768 | 0.5593406389622415 | 1.3969204006797298 | 0.9295410930179658 | 0.9267495967601704 | 0.6310401313739987 | 0.8122862194295644 | 1.3607529336099347 | 0.7869167946062813 | 1.5064369866925733 | 1.9110029055798297 | 1.5261087557333572 | 1.0712254559581413 | 1.3578345624625574 | 0.9606489887513181 | 1.0597403276226423 | 1.092688669192182 | 0.9799303125537122 | 0.7541088381332228 | 1.4230261186039581 | 1.0380474616596684 | 1.2029517360824644 | 1.2167713188906986 | 0.8387961188443237 | 1.1280410278853974 | 0.6987045335183695 | 2.7066285684341302 | 1.012914010372018 | 0.1336756267664963 | 0.9214129715681281 | 1.233837360949184 | 0.6636539510169083 | 0.9813118355623712 | 1.7810646771662655 | 1.3045428421362588 | 0.6939759366190504 | 1.1893643989835918 | 1.1841558699919403 | ||||
| cpd:C00002 | cpd:C00002 | ATP | ATP [-H(+)] | 0.056103326543856406 | 1.3476067368441185 | 0.5888198065880753 | 1.1606847274476217 | 0.9526979696543735 | 1.1634191286340803 | 0.7095379502613193 | 0.7508514407912404 | 0.6699634653361438 | 0.6395117686122658 | 0.834521995868729 | 0.6533826983668959 | 1.2571912531729919 | 1.6922653329197588 | 1.5571552563473847 | 1.1550153193046266 | 1.183549549771364 | 0.9231443892014788 | 1.1129385473142914 | 0.9880662198381269 | 0.8970910098718045 | 1.077079684032704 | 1.4094974664754285 | 0.9123412970234283 | 1.003925182382091 | 1.0356019511842767 | 0.9167881194657693 | 0.9749575076786353 | 0.7514445173124913 | 3.386768340261476 | 1.0164544604527443 | 0.41950033350412735 | 0.9464946928324283 | 1.0593725492475055 | 0.8288086724879334 | 0.8950929844278803 | 1.664575928188429 | 4.943009761748927 | 6.317714564823398 | 8.761565803865293 | 8.007447918866397 | ||||
| cpd:C00010 | cpd:C00010 | CoA | CoA [-H(+)] | 0.00423891865289675 | 1.2980722287115498 | 0.5709359025691771 | 1.0832579004582052 | 0.6235540802718936 | 1.0803470264614428 | 0.7740812737292211 | 1.0539374299665765 | 0.9579542607459615 | 0.6474980016235211 | 1.056558791194407 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.8636165034170068 | 1.156354488565598 | 1.2046152260545933 | 0.9366927378679243 | 1.145345991158144 | 1.1345952859515465 | 0.9422542999930029 | 1.5047080949638167 | 0.7606176271068367 | 1 | 1 | 1 | 1 | 1 | 0.6384481370585724 | 0.6750433846308712 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||
| cpd:C00236 | cpd:C00236 | DGP | 3-Phospho-D-glyceroyl phosphate [-H(+)] | 3.0637042181931676E-4 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0755233960552824 | 1.0532750479417945 | 0.8600482881796523 | 1 | 1 | 1 | 1 | ||||
| cpd:C00085 | cpd:C00085 | F6P | D-Fructose 6-phosphate [-H(+)] | 0.05147393842919186 | 1.258330139855679 | 0.7654723558650324 | 1.1690199055069168 | 1.3081140422024313 | 1.0303548895089745 | 0.8856340927406872 | 0.8758710155096049 | 0.8881006742967001 | 0.7659031367327938 | 0.9895740804838893 | 0.6814878700422817 | 1.2515387894968124 | 1.2546287865635113 | 1.2490839949858366 | 1.0868763473033571 | 1.1535452085237201 | 0.9799311910520146 | 0.9496224850327779 | 0.9703837867510279 | 1.1623368552997335 | 1.0600413899854886 | 1.1088844870703722 | 1.065248206762417 | 1.1896344100413665 | 1.2275006630629464 | 0.8904424235151888 | 0.93263421314894 | 0.9796552796427693 | 0.9599215352881635 | 0.7922336845316652 | 0.5486706821588122 | 0.9447447703867362 | 0.5974140806987471 | 0.9038683630422409 | 1.1446405682164211 | 1.3375018599857151 | 0.7617415237620774 | 0.6637565114800108 | 0.6561560189557547 | 0.5278942634035362 | ||||
| cpd:C00354 | cpd:C00354 | FBP | D-Fructose 1,6-bisphosphate [-H(+)] | 0.14571477370590752 | 0.7962935289023442 | 0.4491409667417326 | 0.8705305705027747 | 0.9380930902607587 | 0.7930997684500125 | 0.7171521664449354 | 1.0046108735074315 | 0.6320890274015687 | 0.8685065883572054 | 1.6308895795080183 | 0.7506029489881456 | 0.9814485834555039 | 1.4321206970694014 | 1.1477766701539216 | 0.7996282526995583 | 1.1500592735360833 | 0.9074549340779384 | 0.9208894931552515 | 0.9747838594961175 | 1.1876840632138923 | 1.3257592941176162 | 1.5108111177321741 | 0.7273159673156712 | 1.0650502526645007 | 0.9888345406244874 | 0.7072187173028386 | 1.0607260610506148 | 1.1396824521908773 | 1.4737567964266949 | 1.1793407727202956 | 1.8066014559064427 | 1.4490238218872764 | 0.7232367240831326 | 0.6407475341838035 | 1.3251236384026304 | 2.032770463413759 | 1.430566262267178 | 1.2312324312378107 | 1.1063737223477428 | 0.587668965561374 | ||||
| cpd:C00085 | cpd:C00085 | G6P | D-Fructose 6-phosphate [-H(+)] | 0.04042098812640118 | 1.258330139855679 | 0.7654723558650324 | 1.1690199055069168 | 1.3081140422024313 | 1.0303548895089745 | 0.8856340927406872 | 0.8758710155096049 | 0.8881006742967001 | 0.7659031367327938 | 0.9895740804838893 | 0.6814878700422817 | 1.2515387894968124 | 1.2546287865635113 | 1.2490839949858366 | 1.0868763473033571 | 1.1535452085237201 | 0.9799311910520146 | 0.9496224850327779 | 0.9703837867510279 | 1.1623368552997335 | 1.0600413899854886 | 1.1088844870703722 | 1.065248206762417 | 1.1896344100413665 | 1.2275006630629464 | 0.8904424235151888 | 0.93263421314894 | 0.9796552796427693 | 0.9599215352881635 | 0.7922336845316652 | 0.5486706821588122 | 0.9447447703867362 | 0.5974140806987471 | 0.9038683630422409 | 1.1446405682164211 | 1.3375018599857151 | 0.7617415237620774 | 0.6637565114800108 | 0.6561560189557547 | 0.5278942634035362 | ||||
| cpd:C00111 | cpd:C00118 | GAP | D-Glyceraldehyde 3-phosphate | 0.029329343511964423 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.8900946927761848 | 0.9679744676032576 | 1.2056183202879653 | 0.9115126698943108 | 0.6054410559670669 | 0.8351267586067098 | 0.9482260852434536 | ||||
| cpd:C00184 | cpd:C00184 | LAC | Glycerone [-H(+)] | 3.8294 | 1 | 1.0144670294072498 | 1.125649544944429 | 1.6407747324968738 | 1 | 1 | 1 | 1 | 1 | 1 | 0.7602414373849116 | 1.2706732061418669 | 1.117190820643546 | 0.9991389400731874 | 0.9482854599194283 | 0.9837263174726587 | 1.001524792815123 | 0.8121631307264842 | 0.9898661801129512 | 1.0561767992874278 | 0.964388951017387 | 0.8117698429090315 | 1.0117348905759818 | 1.006745959362943 | 1.1453011279379364 | 0.8444032666351432 | 1.0368075171065092 | 0.9878424321387262 | 0.9660596781960581 | 0.8617116737587952 | 0.8736724088998133 | 1.1625193485952159 | 0.7591966864903461 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||
| cpd:C00003 | cpd:C00003 | NAD | Deamino-NAD+ [-H(+)] | 0.12081 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||
| cpd:C00004 | cpd:C00004 | NADH | NADH | 0.06822404934887696 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||
| cpd:C00074 | cpd:C00074 | PEP | PEP | 0.4025435907644677 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||
| cpd:C00009 | cpd:C00009 | Pi_Int | Orthophosphate [-H(+)] | 6.946300000000001 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 0.6873690416788762 | 1.1246447429985607 | 1.122611059622912 | 0.9759027492170833 | 0.9997139000406485 | 1.0222666217074121 | 1.0534487676108282 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1.0894713186658456 | 1.0470558676709212 | 0.8366368367928533 | 0.8806683246494331 | 0.9159426407470742 | 1 | 1 | 1 | 1 | 1 | 0.42149980670454945 | 0.5011606203572979 | 0.5489062999839617 | 0.6723582455940159 | ||||
| cpd:C00022 | cpd:C00022 | PYR | Pyruvate [-H(+)] | 1.405039198852948 | 1.1164299162775757 | 0.9943580854516526 | 1.1173118290393027 | 1.7019953463280864 | 0.9155042618947604 | 1.191668693096022 | 1.1140245516271972 | 0.9323936485266614 | 1.0353018537053342 | 1.0378719754374617 | 0.5698579578583572 | 1.2622486195052551 | 1.1904149488374918 | 1.180978798678424 | 1.3715708810851885 | 1.2484426980360308 | 0.9747916486147639 | 0.827698885767989 | 0.9816344940774957 | 1.130305011140209 | 0.9920416126671212 | 0.8464623836926792 | 0.9931651366095623 | 1.1473164467083397 | 1.1773201911344218 | 0.8626007535638385 | 0.8053354764714313 | 1.43944968304706 | 0.668011840300417 | 0.8661809979368797 | 0.6258323614751383 | 1.095758035135992 | 0.794195072388656 | 1.2865308894761802 | 1.3970435171617932 | 0.7337676070499917 | 0.8797015915680265 | 2.7374863962936766 | 2.338193815367179 | 3.3360709322117006 | ||||
| cpd:C00031 | cpd:C00031 | GLC_Ext | D-Glucose [-H(+)] | 5.5 | 1.1544854962928202 | 1.0636563034639035 | 1.2196411558368223 | 0.7707426554042414 | 1.1082037879296296 | 0.9694516480734552 | 0.9711078092699517 | 0.9706501685819292 | 0.9960789246355799 | 0.973789061846656 | 0.7541427353704666 | 1.1756549143581827 | 1.031806127741038 | 1.0183978808358811 | 1.0508540941955486 | 1.080107590273652 | 1.0003448508968409 | 0.8491388212074646 | 0.9647162494241467 | 1.1474209009252734 | 1.112838801565094 | 1.0668316035198424 | 0.9709602048324681 | 1.2946981291592599 | 1.289671073063837 | 0.8484342250107664 | 1.1155786923080515 | 1.0584280698171566 | 0.6049708486128278 | 0.7498680580131396 | 0.9603600612763917 | 1.3231022490700701 | 0.40772802849629325 | 1.217495815772398 | 1.0034682450068266 | 0.8223948643134601 | 1.6482515905428525 | 1.7462137196873047 | 1.523200838112009 | 1.0942343049391232 | ||||
| cpd:C00006 | cpd:C00007 | O2 | Oxygen | 0.273 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20311136018573472 | 0.20239708521276162 | 0.20311136018573472 | 0.14806922619116372 | 0.20239708521276162 | 0.20311136018573472 | 0.14806922619116372 | 0.051948704926353506 | ||||
| !!SBtab TableType ='MultipleSamples'TableName ='Mutant and perturbation Metabolite Samples, mean value' SBtabVersion ='1.xx' #Rightfield like table | ||||||||||||||||||||||||||||||||||||||||||||||||
| !SampleID | WT_WT_5 | blank_control_7 | WT_perturbation_7 | water_control_7 | TF173_MPN303_5 | TF178_MPN250_5 | TF187_MPN674_5 | Tn051_MPN051_5 | Tn674_N/A_5 | dLDH,NoxE_N/A_5 | KO51_mutant_6 | TF173_mutant_6 | TF183_mutant_6 | TF414_mutant_6 | TF462_mutant_6 | TF463_mutant_6 | Tn674_mutant_6 | TF173_mutant_7 | TF178_mutant_7 | TF184_mutant_7 | Tn674_mutant_7 | TF413_mutant_7 | TF462_mutant_7 | TF463_mutant_7 | TF187_mutant_7 | Tn051_Gly_perturbation_7 | AA_perturbation_6 | Fe_perturbation_6 | Glu_perturbation_6 | Gly_perturbation_6 | Ox_perturbation_6 | Gly_ctrl_perturbation_7 | WT_noGluc_perturbation_7 | 6h_timecourse_4 | 24h_timecourse_4 | 48h_timecourse_4 | M129_timecourse_6h_3 | M129_timecourse_24h_3 | M129_timecourse_48h_3 | M129_timecourse_96h_3 | ||||||||
| !Batch | 7 | 7 | 7 | 7 | 5 | 5 | 5 | 5 | 5 | 5 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 6 | 6 | 6 | 6 | 6 | 7 | 7 | 4 | 4 | 4 | 3 | 3 | 3 | 3 | ||||||||
| !Washed | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | ||||||||
| !Description | WT_WT_5 | blank_control_7 | WT_perturbation_7 | water_control_7 | MPN303-OE_5 | MPN250-OE_5 | MPN674-OE_5 | MPN051-KO_5 | MPN674-KO_5 | MPN674-KO, NoxE OE_5 | MPN674-KO, NoxE OE_6 | MPN303-OE_6 | MPN606-OE_6 | MPN430-OE_6 | MPN025-OE_6 | MPN302-OE_6 | MPN674-KO_6 | MPN303-OE_7 | MPN250-OE_7 | MPN627-OE_7 | MPN674-OE_7 | MPN051-OE_7 | MPN025-OE_7 | MPN302-OE_7 | MPN674-OE_7 | Tn051_Gly_perturbation_7 | AA_perturbation_6 | Fe_perturbation_6 | Glu_perturbation_6 | Gly_perturbation_6 | Ox_perturbation_6 | Gly_ctrl_perturbation_7 | WT_noGluc_perturbation_7 | 6h_timecourse_4 | 24h_timecourse_4 | 48h_timecourse_4 | M129_timecourse_6h_3 | M129_timecourse_24h_3 | M129_timecourse_48h_3 | M129_timecourse_96h_3 | ||||||||
| !Growth conditions | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), aerated | adherent (attached to the bottom of the flask), aerated | adherent (attached to the bottom of the flask), aerated | adherent (attached to the bottom of the flask), aerated | ||||||||
| ! | !Time | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 6 | 24 | 48 | 6 | 24 | 48 | 96 | |||||||
| !ExperimentType | control | control | control | control | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant, perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | timecourse | timecourse | timecourse | timecourse, perturbation | timecourse, perturbation | timecourse, perturbation | |||||||||
| !Genes | 0 | 0 | 0 | 0 | pyk | pgi | ldh | glpD | ldh | 0 | 0 | pyk | eno | gap | tsr | pfkA | ldh | pyk | pgi | ptsI | ldh | glpD | tsr | pfkA | ldh | glpD | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||||
| !Est. FC | 0 | 0 | 0 | 0 | 1.291214505 | 1.4085032795 | 1.26939831 | NA | 0 | 0 | 1 | 1.291214505 | 0.549999999999999 | 0.27 | 0.48 | 3.4236509485 | 0 | 1.291214505 | 1.4085032795 | 1.7384333675 | 1.26939831 | 4.03464644 | 0.48 | 3.4236509485 | 1.26939831 | NA | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||||
| !Effected par | 0 | 0 | 0 | 0 | re07_PYK | re02_PGI | re08_LDH | glpD | re08_LDH | re08_LDH | re08_LDH | re07_PYK | re06_ENO | re06_ENO | re04_FBA | re03_PFK | re08_LDH | re07_PYK | re02_PGI | ptsI | re08_LDH | glpD | re04_FBA | re03_PFK | re08_LDH | glpD | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||||||||
| !ParNewValue | 0:0 | 0:0 | 0:0 | 0:0 | re07_PYK:1.291214505 | re02_PGI:1.4085032795 | re08_LDH:1.26939831 | glpD:NA | re08_LDH:0 | re08_LDH:0 | re08_LDH:1 | re07_PYK:1.291214505 | re06_ENO:0.549999999999999 | re06_ENO:0.27 | re04_FBA:0.48 | re03_PFK:3.4236509485 | re08_LDH:0 | re07_PYK:1.291214505 | re02_PGI:1.4085032795 | ptsI:1.7384333675 | re08_LDH:1.26939831 | glpD:4.03464644 | re04_FBA:0.48 | re03_PFK:3.4236509485 | re08_LDH:1.26939831 | glpD:NA | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | ||||||||||||||
| !CompoundID | !Name | !Units | !SBOTerm | !Identifiers: obo.chebi | !Identifiers: kegg.compound | !Means | ||||||||||||||||||||||||||||||||||||||||||
| AcCoA | AcCoA | mM | SBO:0000299 | cpd:C00024 | 0.018599254513170366 | 0.008927870620606805 | 0.014252844303033217 | 0.011197024240671231 | 0.017381692984073903 | 0.0013310781221683458 | 0.013359095805750237 | 0.017947739422072558 | 0.006211454992349207 | 0.013452191147742043 | 0.01438149983680856 | 0.01438149983680856 | 0.01438149983680856 | 0.01438149983680856 | 0.01438149983680856 | 0.01438149983680856 | 0.01438149983680856 | 0.013864237983276717 | 0.012703497992348269 | 0.013125406950504797 | 0.013707245341331917 | 0.01858653201294757 | 0.013731043230713679 | 0.017896848147118793 | 0.01501836795844838 | 0.015498995063875854 | 0.01438149983680856 | 0.01438149983680856 | 0.01438149983680856 | 0.01438149983680856 | 0.01438149983680856 | 0.012299746344743874 | 0.012749571634248578 | 0.01438149983680856 | 0.01438149983680856 | 0.01438149983680856 | 0.015604151094247327 | 0.017753676075644917 | 0.022252815341584718 | 0.01842351264108359 | ||||
| ACE | ACE | mM | SBO:0000300 | cpd:C00033 | 1.081798612169658 | 1.0091747609318953 | 0.9988526689122941 | 0.7776488413444805 | 1.0011634343932245 | 0.6855522965692044 | 0.9393750211518167 | 0.9183496893639064 | 0.8142002390467478 | 0.8177997515804195 | 0.6935685344738104 | 0.9375355665105845 | 0.958830133518421 | 0.8473421349664967 | 0.8394800278691522 | 0.8034602163951948 | 0.7283741512290415 | 0.845271367853749 | 0.8972790140232894 | 0.974729339691394 | 0.9563571525580783 | 0.848370196196572 | 0.8803104278964708 | 0.9553120100521124 | 1.1111073392761264 | 0.7473918702441872 | 0.7963452502988778 | 0.7449424526036622 | 0.5940705957849405 | 0.9130743718629505 | 0.9626268741688915 | 0.8580165147998755 | 0.40817162009745794 | 1.000523101685868 | 0.8354612641457676 | 0.6569226107274477 | 0.3616689425797333 | 0.4970199524587031 | 0.33103576594166756 | 0.28811292808027117 | ||||
| ADP | ADP | mM | SBO:0000301 | cpd:C00008 | 0.8015501619335115 | 0.07197089372285259 | 0.5894418609970016 | 0.2925534656773315 | 0.730635101451674 | 0.48618042264270034 | 0.48472037871283585 | 0.3300546474818259 | 0.42485228510653267 | 0.7117183321361629 | 0.41158324538851393 | 0.7879158612524467 | 0.9995170813693901 | 0.7982048404683372 | 0.5602859828740057 | 0.7101919284854609 | 0.5024508705107581 | 0.5542788847583868 | 0.5715119460506488 | 0.5125356340847097 | 0.3944236100975902 | 0.7442892465659956 | 0.5429328056862202 | 0.6291831397883546 | 0.6364112340177758 | 0.4387178303723557 | 0.5900023870004731 | 0.36544534497708986 | 1.4156553499595301 | 0.5297871878525571 | 0.06991672902524056 | 0.48192914902881084 | 0.6453373327165368 | 0.34711274285499744 | 0.5132582158460601 | 0.9315551340363857 | 0.6823186141089272 | 0.3629721339955787 | 0.622076517668109 | 0.6193522864904574 | ||||
| ATP | ATP | mM | SBO:0000302 | cpd:C00002 | 0.07560522080986634 | 0.03303474988450116 | 0.0651182742784609 | 0.05344952528918832 | 0.06527168328112669 | 0.03980743931876934 | 0.04212526356863603 | 0.0375871790682073 | 0.03587873758309309 | 0.04681946004225409 | 0.036656942884583994 | 0.07053261140484442 | 0.0949417145716451 | 0.08736158982633975 | 0.06480020162210404 | 0.06640106687165706 | 0.051791471114499436 | 0.06243955474321888 | 0.05543380177853224 | 0.050329789866395754 | 0.06042775322704047 | 0.07907749662440926 | 0.05118538170635088 | 0.05632354233278305 | 0.05810071443674632 | 0.051434863237916094 | 0.05469835941967887 | 0.04215853713437326 | 0.19000897012208418 | 0.05702647651173969 | 0.023535364195838723 | 0.05310150082400479 | 0.0594343240620304 | 0.04649892359497067 | 0.05021769399247235 | 0.0933882468561983 | 0.27731929077286993 | 0.3544448032411648 | 0.4915529873297403 | 0.4492444653750849 | ||||
| CoA | CoA | mM | SBO:0000303 | cpd:C00010 | 0.005502422583092644 | 0.0024201508470089264 | 0.004591842120150057 | 0.002643195021954407 | 0.004579503162068949 | 0.0032812675500688703 | 0.004467555030871383 | 0.004060690184497973 | 0.002744691356795314 | 0.004478666767876015 | 0.00423891865289675 | 0.00423891865289675 | 0.00423891865289675 | 0.00423891865289675 | 0.00423891865289675 | 0.00423891865289675 | 0.00423891865289675 | 0.00366080010528382 | 0.004901692610941595 | 0.005106265951286251 | 0.00397056431858127 | 0.004855028485940773 | 0.004809457121108732 | 0.00399413932801251 | 0.006378335210906857 | 0.0032241962472652347 | 0.00423891865289675 | 0.00423891865289675 | 0.00423891865289675 | 0.00423891865289675 | 0.00423891865289675 | 0.0027063297170847635 | 0.002861453994626355 | 0.00423891865289675 | 0.00423891865289675 | 0.00423891865289675 | 0.00423891865289675 | 0.00423891865289675 | 0.00423891865289675 | 0.00423891865289675 | ||||
| DGP | DGP | mM | SBO:0000304 | cpd:C00236 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.2950855652600096E-4 | 3.2269232072968865E-4 | 2.6349335683458137E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | 3.0637042181931676E-4 | ||||
| F6P | F6P | mM | SBO:0000305 | cpd:C00085 | 0.0647712081425276 | 0.03940187691504512 | 0.06017405863856272 | 0.06733378166668923 | 0.053036424142801734 | 0.04558707476052733 | 0.045084530724255154 | 0.04571403942767212 | 0.03942405090290874 | 0.050937275289951865 | 0.03507886466279751 | 0.06442163059230423 | 0.06458068491106188 | 0.06429527265078995 | 0.055945806181237956 | 0.05937751503883926 | 0.050440917793056046 | 0.04888080932555338 | 0.04994947529190845 | 0.05983005572367897 | 0.054564505240507995 | 0.05707865181254634 | 0.05483252060669569 | 0.06123516837571728 | 0.06318429355229428 | 0.04583457848276121 | 0.048006356064586336 | 0.05042671554616464 | 0.04941094200427825 | 0.04077938789911474 | 0.028242240911345397 | 0.04862973414218786 | 0.030751255606619565 | 0.046525664467330745 | 0.058919158131927246 | 0.06884648838983429 | 0.03920983629308796 | 0.034166161803897255 | 0.033774934519672166 | 0.02717279681155721 | ||||
| FBP | FBP | mM | SBO:0000306 | cpd:C00354 | 0.11603173136748361 | 0.0654464743308241 | 0.1268491650848864 | 0.13669402236242192 | 0.11556635328590123 | 0.10449966564622508 | 0.14638664609562946 | 0.09210470958980677 | 0.12655424098455995 | 0.23764470601733356 | 0.10937393885479449 | 0.14301155824220224 | 0.20868114329301435 | 0.16724801775639875 | 0.11651764989096637 | 0.16758062679169078 | 0.13222959036747603 | 0.13418720410326535 | 0.1420404094986479 | 0.17306311450532508 | 0.19318271553085212 | 0.22014750013271295 | 0.10598068159009626 | 0.15519355655242734 | 0.14408780131968218 | 0.1030522153523653 | 0.154563457949949 | 0.16606857061758745 | 0.21474813808885906 | 0.171847373819088 | 0.26324852232417034 | 0.21114417830077373 | 0.10538627558557553 | 0.09336638194621116 | 0.1930900911021881 | 0.29620468807238864 | 0.2084546391775678 | 0.17940875509719192 | 0.1612149965860639 | 0.08563205033076038 | ||||
| G6P | G6P | mM | SBO:0000307 | cpd:C00085 | 0.05086294764219913 | 0.03094114900750881 | 0.04725293972002171 | 0.05287526216784313 | 0.04164796275482165 | 0.0357982051470074 | 0.035403571918172685 | 0.0358979068107958 | 0.030958561595849674 | 0.03999956215743365 | 0.0275464131032655 | 0.05058843454998116 | 0.05071333528472481 | 0.05048920933020025 | 0.04393261592921528 | 0.046627437177004266 | 0.03960978703820365 | 0.038384679192073494 | 0.03922387152231551 | 0.04698280422694901 | 0.04284792043809724 | 0.04482220668542198 | 0.043058385117213806 | 0.048086198363040344 | 0.04961678972681693 | 0.035992562628151335 | 0.03769799645596881 | 0.039598634426406605 | 0.03880097698015965 | 0.0320228683557895 | 0.022177811128845783 | 0.03818751714628187 | 0.024148067462468933 | 0.036535252370360094 | 0.04626750281687306 | 0.054063146801522084 | 0.03079034508737367 | 0.026829694069354985 | 0.026522474651277227 | 0.02133800775302963 | ||||
| GAP | GAP | mM | SBO:0000308 | cpd:C00118 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.029329343511964423 | 0.02610589300260916 | 0.02839005567114682 | 0.03535999386004328 | 0.026734068210838072 | 0.01775718870670458 | 0.024493719579209584 | 0.02781084858111051 | ||||
| LAC | LAC | mM | SBO:0000309 | cpd:C00184 | 3.8294 | 3.8848000424121225 | 4.3105623674101965 | 6.283182760623529 | 3.8294 | 3.8294 | 3.8294 | 3.8294 | 3.8294 | 3.8294 | 2.9112685603217803 | 4.865915975599665 | 4.278170528572395 | 3.8261026571162637 | 3.6313643402154585 | 3.7670815601297996 | 3.835239041606232 | 3.1100974928039986 | 3.7905935501245356 | 4.044523435191276 | 3.693031049025982 | 3.1085914364358453 | 3.8743375899716646 | 3.855232976784454 | 4.3858161393255335 | 3.2335578692526177 | 3.9703507060076664 | 3.7828438096320385 | 3.699428931683985 | 3.2998386834919304 | 3.3456411226409455 | 4.45175159351052 | 2.9072677912461313 | 3.8294 | 3.8294 | 3.8294 | 3.8294 | 3.8294 | 3.8294 | 3.8294 | ||||
| NAD | NAD | mM | SBO:0000310 | cpd:C00003 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | 0.12081 | ||||
| NADH | NADH | mM | SBO:0000311 | cpd:C00004 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | 0.06822404934887696 | ||||
| PEP | PEP | mM | SBO:0000312 | cpd:C00074 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | 0.4025435907644677 | ||||
| Pi_Int | Pi_Int | mM | SBO:0000313 | cpd:C00009 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 4.774671574213978 | 7.812119778290903 | 7.797993203458634 | 6.778913266886627 | 6.944312663852358 | 7.100970634366198 | 7.317571174455097 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 7.567794620848564 | 7.27316417360252 | 5.811530459414198 | 6.117386383512358 | 6.362412365421402 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 6.946300000000001 | 2.9278641073118123 | 3.481212017187899 | 3.8128678315785933 | 4.670402081369713 | ||||
| PYR | PYR | mM | SBO:0000314 | cpd:C00022 | 1.5686277951421088 | 1.3971120877559413 | 1.5698669171423039 | 2.39137017785626 | 1.2863193746790738 | 1.6743412258457744 | 1.5652481635207918 | 1.3100496249414775 | 1.454639687101115 | 1.4582508088805777 | 0.8006727685692833 | 1.7735087891029033 | 1.6725796660172025 | 1.6593215051574497 | 1.9271108519299653 | 1.7541109282623577 | 1.3696204770182323 | 1.1629493793509331 | 1.3792349431250635 | 1.5881228473119118 | 1.3938573526905986 | 1.1893128294427187 | 1.395435947870578 | 1.6120245811138967 | 1.6541810181449077 | 1.211987871717285 | 1.131527912669277 | 2.022483229457571 | 0.9385828209199815 | 1.2170182554028806 | 0.8793189997832769 | 1.5395829918241546 | 1.1158752082419163 | 1.8076263302491828 | 1.9629009041157106 | 1.030972250753765 | 1.2360152194464034 | 3.846275693119311 | 3.285253965106419 | 4.687310429911335 | ||||
| GLC_Ext | GLC_Ext | mM | SBO:0000315 | cpd:C00031 | 6.349670229610511 | 5.850109669051469 | 6.708026357102523 | 4.2390846047233275 | 6.095120833612963 | 5.331984064404003 | 5.341092950984734 | 5.338575927200611 | 5.47843408549569 | 5.355839840156608 | 4.147785044537566 | 6.466102028970004 | 5.674933702575709 | 5.601188344597346 | 5.779697518075517 | 5.940591746505087 | 5.501896679932625 | 4.6702635166410555 | 5.305939371832807 | 6.310814955089004 | 6.120613408608017 | 5.867573819359134 | 5.340281126578574 | 7.120839710375929 | 7.093190901851104 | 4.666388237559215 | 6.135682807694283 | 5.821354383994361 | 3.327339667370553 | 4.124274319072268 | 5.281980337020155 | 7.277062369885385 | 2.2425041567296127 | 6.696226986748189 | 5.519075347537546 | 4.52317175372403 | 9.065383747985688 | 9.604175458280176 | 8.37760460961605 | 6.018288677165177 | ||||
| O2 | O2 | mM | SBO:0000316 | cpd:C00007 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05544940133070558 | 0.05525440426308392 | 0.05544940133070558 | 0.0404228987501877 | 0.05525440426308392 | 0.05544940133070558 | 0.0404228987501877 | 0.014181996444894509 | ||||
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| # Standard Deviation of the FC values corrected per batch, used as input for automated SS simulations using sampling | |||||||||||||||||||||||||||||||||||||||||||||||||||
| SampleID | WT_WT_5 | blank_control_7 | WT_perturbation_7 | water_control_7 | TF173_MPN303_5 | TF178_MPN250_5 | TF187_MPN674_5 | Tn051_MPN051_5 | Tn674_N/A_5 | dLDH,NoxE_N/A_5 | KO51_mutant_6 | TF173_mutant_6 | TF183_mutant_6 | TF414_mutant_6 | TF462_mutant_6 | TF463_mutant_6 | Tn674_mutant_6 | TF173_mutant_7 | TF178_mutant_7 | TF184_mutant_7 | Tn674_mutant_7 | TF413_mutant_7 | TF462_mutant_7 | TF463_mutant_7 | TF187_mutant_7 | Tn051_Gly_perturbation_7 | AA_perturbation_6 | Fe_perturbation_6 | Glu_perturbation_6 | Gly_perturbation_6 | Ox_perturbation_6 | Gly_ctrl_perturbation_7 | WT_noGluc_perturbation_7 | 6h_timecourse_4 | 24h_timecourse_4 | 48h_timecourse_4 | M129_timecourse_6h_3 | M129_timecourse_24h_3 | M129_timecourse_48h_3 | M129_timecourse_96h_3 | |||||||||||
| Batch | 7 | 7 | 7 | 7 | 5 | 5 | 5 | 5 | 5 | 5 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 6 | 6 | 6 | 6 | 6 | 7 | 7 | 4 | 4 | 4 | 3 | 3 | 3 | 3 | |||||||||||
| Washed | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | |||||||||||
| Description | WT_WT_5 | blank_control_7 | WT_perturbation_7 | water_control_7 | MPN303-OE_5 | MPN250-OE_5 | MPN674-OE_5 | MPN051-KO_5 | MPN674-KO_5 | MPN674-KO, NoxE OE_5 | MPN674-KO, NoxE OE_6 | MPN303-OE_6 | MPN606-OE_6 | MPN430-OE_6 | MPN025-OE_6 | MPN302-OE_6 | MPN674-KO_6 | MPN303-OE_7 | MPN250-OE_7 | MPN627-OE_7 | MPN674-OE_7 | MPN051-OE_7 | MPN025-OE_7 | MPN302-OE_7 | MPN674-OE_7 | Tn051_Gly_perturbation_7 | AA_perturbation_6 | Fe_perturbation_6 | Glu_perturbation_6 | Gly_perturbation_6 | Ox_perturbation_6 | Gly_ctrl_perturbation_7 | WT_noGluc_perturbation_7 | 6h_timecourse_4 | 24h_timecourse_4 | 48h_timecourse_4 | M129_timecourse_6h_3 | M129_timecourse_24h_3 | M129_timecourse_48h_3 | M129_timecourse_96h_3 | |||||||||||
| Growth conditions | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), aerated | adherent (attached to the bottom of the flask), aerated | adherent (attached to the bottom of the flask), aerated | adherent (attached to the bottom of the flask), aerated | |||||||||||
| Time | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 6 | 24 | 48 | 6 | 24 | 48 | 96 | |||||||||||
| control | control | control | control | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant, perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | timecourse | timecourse | timecourse | timecourse, perturbation | timecourse, perturbation | timecourse, perturbation | timecourse, perturbation | 0 | |||||||||||
| Genes | 0 | 0 | 0 | 0 | pyk | pgi | ldh | glpD | ldh | 0 | 0 | pyk | eno | gap | tsr | pfkA | ldh | pyk | pgi | ptsI | ldh | glpD | tsr | pfkA | ldh | glpD | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||||||||||||
| Est. FC | 0 | 0 | 0 | 0 | 1.291214505 | 1.4085032795 | 1.26939831 | NA | 0 | 0 | 1 | 1.291214505 | 0.549999999999999 | 0.27 | 0.48 | 3.4236509485 | 0 | 1.291214505 | 1.4085032795 | 1.7384333675 | 1.26939831 | 4.03464644 | 0.48 | 3.4236509485 | 1.26939831 | NA | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||||||||||||
| Effected par | 0 | 0 | 0 | 0 | re07_PYK | re02_PGI | re08_LDH | glpD | re08_LDH | re08_LDH | re08_LDH | re07_PYK | re06_ENO | re06_ENO | re04_FBA | re03_PFK | re08_LDH | re07_PYK | re02_PGI | ptsI | re08_LDH | glpD | re04_FBA | re03_PFK | re08_LDH | glpD | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||||||||||||
| ParNewValue | 0:0 | 0:0 | 0:0 | 0:0 | re07_PYK:1.291214505 | re02_PGI:1.4085032795 | re08_LDH:1.26939831 | glpD:NA | re08_LDH:0 | re08_LDH:0 | re08_LDH:1 | re07_PYK:1.291214505 | re06_ENO:0.549999999999999 | re06_ENO:0.27 | re04_FBA:0.48 | re03_PFK:3.4236509485 | re08_LDH:0 | re07_PYK:1.291214505 | re02_PGI:1.4085032795 | ptsI:1.7384333675 | re08_LDH:1.26939831 | glpD:4.03464644 | re04_FBA:0.48 | re03_PFK:3.4236509485 | re08_LDH:1.26939831 | glpD:NA | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | |||||||||||||||||
| KEGG ID DATA | KEGG ID Model | Metabolite | |||||||||||||||||||||||||||||||||||||||||||||||||
| 0.31 | cpd:C00024 | cpd:C00024 | AcCoA | Acetyl-CoA [-H(+)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||
| cpd:C00033 | cpd:C00033 | ACE | Acetate [-H(+)] | 0.2828688445921118 | 0.22278334033323524 | 0.36576628036707043 | 0.12410195869402284 | 2.3406635272921276E-4 | 0.536653409599258 | 0.20716782465966277 | 0.3172759577484522 | 0.43250050004559853 | 0.4450128216014907 | 0.18259767485244296 | 0.16176823513891012 | 0.295888727724913 | 0.3301524901800953 | 0.24060179169989637 | 0.1049093640750543 | 0.029332397417342414 | 0.15665950980213464 | 0.1619286433736492 | 0.0523741206325975 | 0.06889346812800912 | 0.4599985254919134 | 0.22790937670716302 | 0.5967861214210386 | 0.13286255683589918 | 0.09179121840539753 | 0.1915522731973044 | 0.2230672076963204 | 0.14421255195346064 | 0.13787710342993265 | 0.16367475329120756 | 0.2511090213316432 | 0.0700850426335601 | 0.18953077036862737 | 0.31420541936005697 | 0.2567625163539551 | 0.010422359448373136 | 0.12478569461208033 | 0.3139648950727054 | 0.19525435786682718 | ||||||||
| cpd:C00008 | cpd:C00008 | ADP | ADP [-H(+)] | 0.5895417700708828 | 0.33678975537631956 | 0.47867034430456357 | 0.1836926728777882 | 0.06221701698056439 | 1.1242349901533042 | 0.07668564887434047 | 0.8739542256745818 | 0.48327263401097575 | 0.6147636166562959 | 0.45349029886346925 | 0.3004413644082918 | 0.3778680144118334 | 0.5413311637940246 | 0.3645507638418791 | 0.43310938072262795 | 0.2706428856919255 | 0.45804115751416463 | 0.20071462679288593 | 0.34958967017880965 | 0.0673078224614734 | 0.12149767294181874 | 0.47842542553320383 | 0.7347427533184957 | 0.23076939578999023 | 0.1099865855933098 | 0.3639278745472173 | 0.4960862426358178 | 0.22951617238614017 | 0.2384645101584479 | 0.1372089795632972 | 0.3120116550891818 | 0.7852310530635936 | 0.28413647699881367 | 0.4465085502868775 | 0.23637020002269574 | 0.05390775891192362 | 0.22657642411541024 | 0.20305274804950874 | 0.17388051275804461 | ||||||||
| cpd:C00002 | cpd:C00002 | ATP | ATP [-H(+)] | 0.4531429648785926 | 0.09834744257386081 | 0.34950314943081034 | 0.1728988104561672 | 0.004171800046826592 | 0.6366647822583642 | 0.38521751724134484 | 0.47889124279184914 | 0.36001304144009677 | 0.353854785444419 | 0.5745763902080826 | 0.40855837137725115 | 3.576929255630531E-4 | 0.5052413521890965 | 0.3303187920876297 | 0.2726947523667544 | 0.07393898370600988 | 0.20701225214011534 | 0.02985304924059541 | 0.028706165735483742 | 0.6263608667895106 | 0.3558499295403427 | 0.42848423235065286 | 0.45948434852133124 | 0.1176480351280377 | 0.12419537447388616 | 0.880943310534861 | 0.34200956461632565 | 0.33261136869833885 | 0.24057218290358043 | 0.047164127287330215 | 0.03511195911860151 | 0.6346944170531865 | 0.312109567974247 | 0.46635516461050897 | 0.31941420027935147 | 1.0286249221828938 | 0.27343985381862446 | 0.5893218884004394 | 0.2593137857745442 | ||||||||
| cpd:C00010 | cpd:C00010 | CoA | CoA [-H(+)] | 0.77110229688294 | 0.23477644995705957 | 0.13190164139771965 | 0.057224724021478456 | 0.37651703966392147 | 0.8681570534656645 | 0.40080710031112693 | 0.21162142312461457 | 0.6864677138796574 | 0.8547074420123674 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.5332135554093319 | 0.3504979486057159 | 0.19607806086586788 | 0.09189476976935711 | 0.7162310088065753 | 0.4298757381294053 | 0.7184378209581567 | 0.08058480220649411 | 0.18268801600427767 | 0 | 0 | 0 | 0 | 0 | 0.43977109806727965 | 0.03972478681669358 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||
| 0.65 | cpd:C00236 | cpd:C00236 | DGP | 3-Phospho-D-glyceroyl phosphate [-H(+)] | 0 | 1.88411095042053E-15 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.149541113927883 | 0.12603615120046785 | 0.2590520783862535 | 0 | 0 | 0 | 0 | ||||||
| cpd:C00085 | cpd:C00085 | F6P | D-Fructose 6-phosphate [-H(+)] | 0.3469460561415271 | 0.06382160747110137 | 0.4398684096111525 | 0.2485045821508931 | 0.2877892872730671 | 0.0497753237514912 | 0.3094856403454753 | 0.2039343983894401 | 0.1752796018629746 | 0.20654783317805747 | 0.3192784552110236 | 0.12192507601333659 | 0.2280452934295017 | 0.14695601292818256 | 0.2621351744416431 | 0.040510577111196946 | 0.05928754184958003 | 0.1368622786560982 | 0.20236285478374783 | 0.17062099523899613 | 0.12271495413963351 | 0.24300487996443282 | 0.23611333191355338 | 0.6823065856676375 | 0.14952371191355815 | 0.15037678431770776 | 0.06655667638953276 | 0.1268177151452886 | 0.12694637178369192 | 0.12263578244490958 | 0.09416603518988238 | 0.0888786698578566 | 0.06690187287014192 | 0.24836997374053463 | 0.7686087295711653 | 0.7462598247962056 | 0.262667113789628 | 0.13807538397445226 | 0.2279366405614094 | 0.10738912149028662 | ||||||||
| cpd:C00354 | cpd:C00354 | FBP | D-Fructose 1,6-bisphosphate [-H(+)] | 0.32794538420410335 | 0.17681321436107358 | 0.5603147144145293 | 0.08031310210033611 | 0.17386830826347083 | 0.5941829108014679 | 0.15397941144159003 | 0.17102892789791616 | 0.26563270585998816 | 0.48735936146122255 | 0.6278647281534981 | 0.3306245448757229 | 0.6543624657727082 | 0.2512060950573096 | 0.17824159483963672 | 0.10901910202458916 | 0.1489435690285437 | 0.24471858329685503 | 0.14517546812205964 | 0.06859043785809532 | 0.7103023967630802 | 0.5068736145160638 | 0.3741486119588413 | 0.6308741192675713 | 0.09367591608289809 | 0.10707453842029939 | 0.2045936963742844 | 0.34399004135604216 | 0.1703389080085366 | 0.33638138564655384 | 0.24627900821968945 | 0.4411215885288512 | 0.4881685229422956 | 0.826638528453413 | 0.7789010908986459 | 1.1988443959315802 | 1.1416685669509439 | 0.0668087729024739 | 0.5891458117155742 | 0.3431485988649674 | ||||||||
| cpd:C00085 | cpd:C00085 | G6P | D-Fructose 6-phosphate [-H(+)] | 0.3469460561415271 | 0.06382160747110137 | 0.4398684096111525 | 0.2485045821508931 | 0.2877892872730671 | 0.0497753237514912 | 0.3094856403454753 | 0.2039343983894401 | 0.1752796018629746 | 0.20654783317805747 | 0.3192784552110236 | 0.12192507601333659 | 0.2280452934295017 | 0.14695601292818256 | 0.2621351744416431 | 0.040510577111196946 | 0.05928754184958003 | 0.1368622786560982 | 0.20236285478374783 | 0.17062099523899613 | 0.12271495413963351 | 0.24300487996443282 | 0.23611333191355338 | 0.6823065856676375 | 0.14952371191355815 | 0.15037678431770776 | 0.06655667638953276 | 0.1268177151452886 | 0.12694637178369192 | 0.12263578244490958 | 0.09416603518988238 | 0.0888786698578566 | 0.06690187287014192 | 0.24836997374053463 | 0.7686087295711653 | 0.7462598247962056 | 0.262667113789628 | 0.13807538397445226 | 0.2279366405614094 | 0.10738912149028662 | ||||||||
| cpd:C00111 | cpd:C00118 | GAP | D-Glyceraldehyde 3-phosphate | 0.0248 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.13343714379914012 | 0.22783420322507422 | 0.40876865091946035 | 0.34585649767281423 | 0.7122931260731681 | 0.8171807912719325 | 1.256944839039541 | |||||||
| cpd:C00184 | cpd:C00184 | LAC | Glycerone [-H(+)] | 0.195 | 9.42055475210265E-16 | 0.24808912156569504 | 0.5085258704363791 | 0.21599699084172946 | 0 | 0 | 0 | 0 | 0 | 0 | 0.34518876782689367 | 0.14566101540568305 | 0.36179036563378386 | 0.28504908210457847 | 0.18405340779859594 | 0.04665586934416262 | 0.12690727167522273 | 0.13159424585847368 | 0.4874775884906531 | 0.22603054041547604 | 0.5373288237813475 | 0.6946831202135554 | 0.1090481123178168 | 0.4598363286275444 | 0.34919809796377316 | 0.22936082895386495 | 0.192640241087421 | 0.14930013975391362 | 0.07195516161667635 | 0.08180760288561799 | 0.04677999139976147 | 0.05986511809622349 | 0.0957818973523852 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| 0.5 | cpd:C00003 | cpd:C00003 | NAD | Deamino-NAD+ [-H(+)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||
| cpd:C00004 | cpd:C00004 | NADH | NADH | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||||
| 0.32 | cpd:C00074 | cpd:C00074 | PEP | PEP | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | ||||||
| cpd:C00009 | cpd:C00009 | Pi_Int | Orthophosphate [-H(+)] | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.22025716790359165 | 0.05739413928205459 | 0.12221600295875605 | 0.088770243568956 | 0.06185928784496783 | 0.02743440192187765 | 0.03152235081499938 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.04256236664951486 | 0.014353063064127534 | 0.05264783188112539 | 0.05118225063642962 | 0.2763734837451712 | 0 | 0 | 0 | 0 | 0 | 0.17812801660193583 | 0.30389742739364384 | 0.22449664002787564 | 0.3940012019326883 | ||||||||
| cpd:C00022 | cpd:C00022 | PYR | Pyruvate [-H(+)] | 0.22901365643489027 | 0.1807217436599648 | 0.4338394656553729 | 0.19472787603335884 | 0.15622298044352484 | 0.09323093684180385 | 0.19520200264626764 | 0.11356471451851365 | 0.10921326243227017 | 0.18845314822671713 | 0.20010047984089688 | 0.1885355883848589 | 0.23714738338625788 | 0.15993912014900805 | 0.17840248754933594 | 0.031278127727150315 | 0.041535041578363754 | 0.30211056291324523 | 0.2724099444679927 | 0.022482886559768087 | 0.02271091014204241 | 0.4363270062350722 | 0.1495694979119514 | 0.4389070386908259 | 0.2128203468963732 | 0.2321458830044049 | 0.1612195188882726 | 0.07069085528282776 | 0.14736920341685983 | 0.0682685365056386 | 0.07915348554525355 | 0.0497456408003661 | 0.12199420048557284 | 0.597940904647548 | 0.5890091384458853 | 0.2424332406423986 | 0.023572838222344735 | 0.20678413118936997 | 0.5818903979115756 | 0.641954640683848 | ||||||||
| cpd:C00031 | cpd:C00031 | GLC_Ext | D-Glucose [-H(+)] | 0.30532699315509065 | 0.19697149668364858 | 0.6891340924517997 | 0.24820276442439193 | 0.13323658114757495 | 0.1938677392961357 | 0.154119599445766 | 0.1570856009018937 | 0.1341612889624867 | 0.372737418226619 | 0.1702101360206934 | 0.10016455556576688 | 0.180442495793233 | 0.04332367442280744 | 0.09535272830461432 | 0.039821288408100966 | 0.046353590865012784 | 0.1370249952648783 | 0.2843894874437139 | 0.12521632773763386 | 0.15936877022763837 | 0.5678873209390369 | 0.3891504176563905 | 0.8953245030951492 | 0.1900921470091982 | 0.15275648304313458 | 0.17991215134236666 | 0.029032401385783727 | 0.17763702710543197 | 0.05898885081161307 | 0.10970166578382025 | 0.35250357742681904 | 0.11744739655931684 | 0.12465410101109349 | 0.1022967258648439 | 0.13236912961327174 | 0.08327226301753349 | 0.15917508795563895 | 0.19633615143861863 | 0.5245370794063307 | ||||||||
| cpd:C00006 | cpd:C00007 | O2 | Oxygen | 0.027300000000000005 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020311136018573473 | 0.020239708521276163 | 0.020311136018573473 | 0.014806922619116373 | 0.020239708521276163 | 0.020311136018573473 | 0.014806922619116373 | 0.005194870492635351 | |||||||
| !!SBtab TableType ='MultipleSamples'TableName ='Mutant and perturbation Metabolite Samples, mean value' SBtabVersion ='1.xx' #Rightfield like table | |||||||||||||||||||||||||||||||||||||||||||||||||||
| !SampleID | WT_WT_5 | blank_control_7 | WT_perturbation_7 | water_control_7 | TF173_MPN303_5 | TF178_MPN250_5 | TF187_MPN674_5 | Tn051_MPN051_5 | Tn674_N/A_5 | dLDH,NoxE_N/A_5 | KO51_mutant_6 | TF173_mutant_6 | TF183_mutant_6 | TF414_mutant_6 | TF462_mutant_6 | TF463_mutant_6 | Tn674_mutant_6 | TF173_mutant_7 | TF178_mutant_7 | TF184_mutant_7 | Tn674_mutant_7 | TF413_mutant_7 | TF462_mutant_7 | TF463_mutant_7 | TF187_mutant_7 | Tn051_Gly_perturbation_7 | AA_perturbation_6 | Fe_perturbation_6 | Glu_perturbation_6 | Gly_perturbation_6 | Ox_perturbation_6 | Gly_ctrl_perturbation_7 | WT_noGluc_perturbation_7 | 6h_timecourse_4 | 24h_timecourse_4 | 48h_timecourse_4 | M129_timecourse_6h_3 | M129_timecourse_24h_3 | M129_timecourse_48h_3 | M129_timecourse_96h_3 | |||||||||||
| !Batch | 7 | 7 | 7 | 7 | 5 | 5 | 5 | 5 | 5 | 5 | 6 | 6 | 6 | 6 | 6 | 6 | 6 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 7 | 6 | 6 | 6 | 6 | 6 | 7 | 7 | 4 | 4 | 4 | 3 | 3 | 3 | 3 | |||||||||||
| !Washed | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | 1 | |||||||||||
| !Description | WT_WT_5 | blank_control_7 | WT_perturbation_7 | water_control_7 | MPN303-OE_5 | MPN250-OE_5 | MPN674-OE_5 | MPN051-KO_5 | MPN674-KO_5 | MPN674-KO, NoxE OE_5 | MPN674-KO, NoxE OE_6 | MPN303-OE_6 | MPN606-OE_6 | MPN430-OE_6 | MPN025-OE_6 | MPN302-OE_6 | MPN674-KO_6 | MPN303-OE_7 | MPN250-OE_7 | MPN627-OE_7 | MPN674-OE_7 | MPN051-OE_7 | MPN025-OE_7 | MPN302-OE_7 | MPN674-OE_7 | Tn051_Gly_perturbation_7 | AA_perturbation_6 | Fe_perturbation_6 | Glu_perturbation_6 | Gly_perturbation_6 | Ox_perturbation_6 | Gly_ctrl_perturbation_7 | WT_noGluc_perturbation_7 | 6h_timecourse_4 | 24h_timecourse_4 | 48h_timecourse_4 | M129_timecourse_6h_3 | M129_timecourse_24h_3 | M129_timecourse_48h_3 | M129_timecourse_96h_3 | |||||||||||
| !Growth conditions | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), not aerated, not stired | adherent (attached to the bottom of the flask), aerated | adherent (attached to the bottom of the flask), aerated | adherent (attached to the bottom of the flask), aerated | adherent (attached to the bottom of the flask), aerated | |||||||||||
| !Time | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 24 | 6 | 24 | 48 | 6 | 24 | 48 | 96 | |||||||||||
| !ExperimentType | control | control | control | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant | mutant, perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | perturbation | timecourse | timecourse | timecourse | timecourse, perturbation | timecourse, perturbation | timecourse, perturbation | timecourse, perturbation | 0 | |||||||||||
| !Genes | 0 | 0 | 0 | 0 | pyk | pgi | ldh | glpD | ldh | 0 | 0 | pyk | eno | gap | tsr | pfkA | ldh | pyk | pgi | ptsI | ldh | glpD | tsr | pfkA | ldh | glpD | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||||||||||||
| !Est. FC | 0 | 0 | 0 | 0 | 1.291214505 | 1.4085032795 | 1.26939831 | NA | 0 | 0 | 1 | 1.291214505 | 0.549999999999999 | 0.27 | 0.48 | 3.4236509485 | 0 | 1.291214505 | 1.4085032795 | 1.7384333675 | 1.26939831 | 4.03464644 | 0.48 | 3.4236509485 | 1.26939831 | NA | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||||||||||||
| !Effected par | 0 | 0 | 0 | 0 | re07_PYK | re02_PGI | re08_LDH | glpD | re08_LDH | re08_LDH | re08_LDH | re07_PYK | re06_ENO | re06_ENO | re04_FBA | re03_PFK | re08_LDH | re07_PYK | re02_PGI | ptsI | re08_LDH | glpD | re04_FBA | re03_PFK | re08_LDH | glpD | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||||||||||||
| !ParNewValue | 0:0 | 0:0 | 0:0 | 0:0 | re07_PYK:1.291214505 | re02_PGI:1.4085032795 | re08_LDH:1.26939831 | glpD:NA | re08_LDH:0 | re08_LDH:0 | re08_LDH:1 | re07_PYK:1.291214505 | re06_ENO:0.549999999999999 | re06_ENO:0.27 | re04_FBA:0.48 | re03_PFK:3.4236509485 | re08_LDH:0 | re07_PYK:1.291214505 | re02_PGI:1.4085032795 | ptsI:1.7384333675 | re08_LDH:1.26939831 | glpD:4.03464644 | re04_FBA:0.48 | re03_PFK:3.4236509485 | re08_LDH:1.26939831 | glpD:NA | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | 0:0 | |||||||||||||||||
| !CompoundID | !Name | !Units | !SBOTerm | !Identifiers: obo.chebi | !Identifiers: kegg.compound | !SD | |||||||||||||||||||||||||||||||||||||||||||||
| AcCoA | AcCoA | mM | SBO:0000299 | cpd:C00024 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| ACE | ACE | mM | SBO:0000299 | cpd:C00033 | 0.2828688445921118 | 0.22278334033323524 | 0.36576628036707043 | 0.12410195869402284 | 2.3406635272921276E-4 | 0.536653409599258 | 0.20716782465966277 | 0.3172759577484522 | 0.43250050004559853 | 0.4450128216014907 | 0.18259767485244296 | 0.16176823513891012 | 0.295888727724913 | 0.3301524901800953 | 0.24060179169989637 | 0.1049093640750543 | 0.029332397417342414 | 0.15665950980213464 | 0.1619286433736492 | 0.0523741206325975 | 0.06889346812800912 | 0.4599985254919134 | 0.22790937670716302 | 0.5967861214210386 | 0.13286255683589918 | 0.09179121840539753 | 0.1915522731973044 | 0.2230672076963204 | 0.14421255195346064 | 0.13787710342993265 | 0.16367475329120756 | 0.2511090213316432 | 0.0700850426335601 | 0.18953077036862737 | 0.31420541936005697 | 0.2567625163539551 | 0.010422359448373136 | 0.12478569461208033 | 0.3139648950727054 | 0.19525435786682718 | |||||||
| ADP | ADP | mM | SBO:0000299 | cpd:C00008 | 0.5895417700708828 | 0.33678975537631956 | 0.47867034430456357 | 0.1836926728777882 | 0.06221701698056439 | 1.1242349901533042 | 0.07668564887434047 | 0.8739542256745818 | 0.48327263401097575 | 0.6147636166562959 | 0.45349029886346925 | 0.3004413644082918 | 0.3778680144118334 | 0.5413311637940246 | 0.3645507638418791 | 0.43310938072262795 | 0.2706428856919255 | 0.45804115751416463 | 0.20071462679288593 | 0.34958967017880965 | 0.0673078224614734 | 0.12149767294181874 | 0.47842542553320383 | 0.7347427533184957 | 0.23076939578999023 | 0.1099865855933098 | 0.3639278745472173 | 0.4960862426358178 | 0.22951617238614017 | 0.2384645101584479 | 0.1372089795632972 | 0.3120116550891818 | 0.7852310530635936 | 0.28413647699881367 | 0.4465085502868775 | 0.23637020002269574 | 0.05390775891192362 | 0.22657642411541024 | 0.20305274804950874 | 0.17388051275804461 | |||||||
| ATP | ATP | mM | SBO:0000299 | cpd:C00002 | 0.4531429648785926 | 0.09834744257386081 | 0.34950314943081034 | 0.1728988104561672 | 0.004171800046826592 | 0.6366647822583642 | 0.38521751724134484 | 0.47889124279184914 | 0.36001304144009677 | 0.353854785444419 | 0.5745763902080826 | 0.40855837137725115 | 3.576929255630531E-4 | 0.5052413521890965 | 0.3303187920876297 | 0.2726947523667544 | 0.07393898370600988 | 0.20701225214011534 | 0.02985304924059541 | 0.028706165735483742 | 0.6263608667895106 | 0.3558499295403427 | 0.42848423235065286 | 0.45948434852133124 | 0.1176480351280377 | 0.12419537447388616 | 0.880943310534861 | 0.34200956461632565 | 0.33261136869833885 | 0.24057218290358043 | 0.047164127287330215 | 0.03511195911860151 | 0.6346944170531865 | 0.312109567974247 | 0.46635516461050897 | 0.31941420027935147 | 1.0286249221828938 | 0.27343985381862446 | 0.5893218884004394 | 0.2593137857745442 | |||||||
| CoA | CoA | mM | SBO:0000299 | cpd:C00010 | 0.77110229688294 | 0.23477644995705957 | 0.13190164139771965 | 0.057224724021478456 | 0.37651703966392147 | 0.8681570534656645 | 0.40080710031112693 | 0.21162142312461457 | 0.6864677138796574 | 0.8547074420123674 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.5332135554093319 | 0.3504979486057159 | 0.19607806086586788 | 0.09189476976935711 | 0.7162310088065753 | 0.4298757381294053 | 0.7184378209581567 | 0.08058480220649411 | 0.18268801600427767 | 0 | 0 | 0 | 0 | 0 | 0.43977109806727965 | 0.03972478681669358 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| DGP | DGP | mM | SBO:0000299 | cpd:C00236 | 1.88411095042053E-15 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.149541113927883 | 0.12603615120046785 | 0.2590520783862535 | 0 | 0 | 0 | 0 | |||||||
| F6P | F6P | mM | SBO:0000299 | cpd:C00085 | 0.3469460561415271 | 0.06382160747110137 | 0.4398684096111525 | 0.2485045821508931 | 0.2877892872730671 | 0.0497753237514912 | 0.3094856403454753 | 0.2039343983894401 | 0.1752796018629746 | 0.20654783317805747 | 0.3192784552110236 | 0.12192507601333659 | 0.2280452934295017 | 0.14695601292818256 | 0.2621351744416431 | 0.040510577111196946 | 0.05928754184958003 | 0.1368622786560982 | 0.20236285478374783 | 0.17062099523899613 | 0.12271495413963351 | 0.24300487996443282 | 0.23611333191355338 | 0.6823065856676375 | 0.14952371191355815 | 0.15037678431770776 | 0.06655667638953276 | 0.1268177151452886 | 0.12694637178369192 | 0.12263578244490958 | 0.09416603518988238 | 0.0888786698578566 | 0.06690187287014192 | 0.24836997374053463 | 0.7686087295711653 | 0.7462598247962056 | 0.262667113789628 | 0.13807538397445226 | 0.2279366405614094 | 0.10738912149028662 | |||||||
| FBP | FBP | mM | SBO:0000299 | cpd:C00354 | 0.32794538420410335 | 0.17681321436107358 | 0.5603147144145293 | 0.08031310210033611 | 0.17386830826347083 | 0.5941829108014679 | 0.15397941144159003 | 0.17102892789791616 | 0.26563270585998816 | 0.48735936146122255 | 0.6278647281534981 | 0.3306245448757229 | 0.6543624657727082 | 0.2512060950573096 | 0.17824159483963672 | 0.10901910202458916 | 0.1489435690285437 | 0.24471858329685503 | 0.14517546812205964 | 0.06859043785809532 | 0.7103023967630802 | 0.5068736145160638 | 0.3741486119588413 | 0.6308741192675713 | 0.09367591608289809 | 0.10707453842029939 | 0.2045936963742844 | 0.34399004135604216 | 0.1703389080085366 | 0.33638138564655384 | 0.24627900821968945 | 0.4411215885288512 | 0.4881685229422956 | 0.826638528453413 | 0.7789010908986459 | 1.1988443959315802 | 1.1416685669509439 | 0.0668087729024739 | 0.5891458117155742 | 0.3431485988649674 | |||||||
| G6P | G6P | mM | SBO:0000299 | cpd:C00085 | 0.3469460561415271 | 0.06382160747110137 | 0.4398684096111525 | 0.2485045821508931 | 0.2877892872730671 | 0.0497753237514912 | 0.3094856403454753 | 0.2039343983894401 | 0.1752796018629746 | 0.20654783317805747 | 0.3192784552110236 | 0.12192507601333659 | 0.2280452934295017 | 0.14695601292818256 | 0.2621351744416431 | 0.040510577111196946 | 0.05928754184958003 | 0.1368622786560982 | 0.20236285478374783 | 0.17062099523899613 | 0.12271495413963351 | 0.24300487996443282 | 0.23611333191355338 | 0.6823065856676375 | 0.14952371191355815 | 0.15037678431770776 | 0.06655667638953276 | 0.1268177151452886 | 0.12694637178369192 | 0.12263578244490958 | 0.09416603518988238 | 0.0888786698578566 | 0.06690187287014192 | 0.24836997374053463 | 0.7686087295711653 | 0.7462598247962056 | 0.262667113789628 | 0.13807538397445226 | 0.2279366405614094 | 0.10738912149028662 | |||||||
| GAP | GAP | mM | SBO:0000299 | cpd:C00118 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.13343714379914012 | 0.22783420322507422 | 0.40876865091946035 | 0.34585649767281423 | 0.7122931260731681 | 0.8171807912719325 | 1.256944839039541 | |||||||
| LAC | LAC | mM | SBO:0000299 | cpd:C00184 | 9.42055475210265E-16 | 0.24808912156569504 | 0.5085258704363791 | 0.21599699084172946 | 0 | 0 | 0 | 0 | 0 | 0 | 0.34518876782689367 | 0.14566101540568305 | 0.36179036563378386 | 0.28504908210457847 | 0.18405340779859594 | 0.04665586934416262 | 0.12690727167522273 | 0.13159424585847368 | 0.4874775884906531 | 0.22603054041547604 | 0.5373288237813475 | 0.6946831202135554 | 0.1090481123178168 | 0.4598363286275444 | 0.34919809796377316 | 0.22936082895386495 | 0.192640241087421 | 0.14930013975391362 | 0.07195516161667635 | 0.08180760288561799 | 0.04677999139976147 | 0.05986511809622349 | 0.0957818973523852 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| NAD | NAD | mM | SBO:0000299 | cpd:C00003 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| NADH | NADH | mM | SBO:0000299 | cpd:C00004 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| PEP | PEP | mM | SBO:0000299 | cpd:C00074 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
| Pi_Int | Pi_Int | mM | SBO:0000299 | cpd:C00009 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.22025716790359165 | 0.05739413928205459 | 0.12221600295875605 | 0.088770243568956 | 0.06185928784496783 | 0.02743440192187765 | 0.03152235081499938 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.04256236664951486 | 0.014353063064127534 | 0.05264783188112539 | 0.05118225063642962 | 0.2763734837451712 | 0 | 0 | 0 | 0 | 0 | 0.17812801660193583 | 0.30389742739364384 | 0.22449664002787564 | 0.3940012019326883 | |||||||
| PYR | PYR | mM | SBO:0000299 | cpd:C00022 | 0.22901365643489027 | 0.1807217436599648 | 0.4338394656553729 | 0.19472787603335884 | 0.15622298044352484 | 0.09323093684180385 | 0.19520200264626764 | 0.11356471451851365 | 0.10921326243227017 | 0.18845314822671713 | 0.20010047984089688 | 0.1885355883848589 | 0.23714738338625788 | 0.15993912014900805 | 0.17840248754933594 | 0.031278127727150315 | 0.041535041578363754 | 0.30211056291324523 | 0.2724099444679927 | 0.022482886559768087 | 0.02271091014204241 | 0.4363270062350722 | 0.1495694979119514 | 0.4389070386908259 | 0.2128203468963732 | 0.2321458830044049 | 0.1612195188882726 | 0.07069085528282776 | 0.14736920341685983 | 0.0682685365056386 | 0.07915348554525355 | 0.0497456408003661 | 0.12199420048557284 | 0.597940904647548 | 0.5890091384458853 | 0.2424332406423986 | 0.023572838222344735 | 0.20678413118936997 | 0.5818903979115756 | 0.641954640683848 | |||||||
| GLC_Ext | GLC_Ext | mM | SBO:0000299 | cpd:C00031 | 0.30532699315509065 | 0.19697149668364858 | 0.6891340924517997 | 0.24820276442439193 | 0.13323658114757495 | 0.1938677392961357 | 0.154119599445766 | 0.1570856009018937 | 0.1341612889624867 | 0.372737418226619 | 0.1702101360206934 | 0.10016455556576688 | 0.180442495793233 | 0.04332367442280744 | 0.09535272830461432 | 0.039821288408100966 | 0.046353590865012784 | 0.1370249952648783 | 0.2843894874437139 | 0.12521632773763386 | 0.15936877022763837 | 0.5678873209390369 | 0.3891504176563905 | 0.8953245030951492 | 0.1900921470091982 | 0.15275648304313458 | 0.17991215134236666 | 0.029032401385783727 | 0.17763702710543197 | 0.05898885081161307 | 0.10970166578382025 | 0.35250357742681904 | 0.11744739655931684 | 0.12465410101109349 | 0.1022967258648439 | 0.13236912961327174 | 0.08327226301753349 | 0.15917508795563895 | 0.19633615143861863 | 0.5245370794063307 | |||||||
| O2 | O2 | mM | SBO:0000299 | cpd:C00007 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | |||||||
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| # List of genes used to map KO description labels to locusu tag | |||||||||
| All mutant targets | Unique genes targetted | ||||||||
| gpsA | 0 | ||||||||
| KOMPN51-gpsA | 65 | KOMPN51 | |||||||
| KOMPN51-gpsA | KO51 | MPN025 | |||||||
| KOMPN51-gpsA | 0 | MPN033 | |||||||
| KOMPN51-gpsA | 6 | MPN051 | |||||||
| MPN025 | 1 | MPN053 | |||||||
| MPN025 | mutant | MPN05 | |||||||
| MPN033 | Cm | MPN063 | |||||||
| MPN051 | gpsA | MPN064 | |||||||
| MPN051-KO | 0 | MPN076 | |||||||
| MPN051-KO | 0 | MPN082 | |||||||
| MPN053 | 0 | MPN114 | |||||||
| MPN053-P | MPN159 | ||||||||
| MPN05-KO1 | MPN162 | ||||||||
| MPN063 | MPN194 | ||||||||
| MPN063 | MPN244 | ||||||||
| MPN063 | MPN246 | ||||||||
| MPN064 | MPN250 | ||||||||
| MPN064 | MPN255 | ||||||||
| MPN064 | MPN273 | ||||||||
| MPN076-KO | MPN302 | ||||||||
| MPN082 | MPN303 | ||||||||
| MPN082 | MPN348 | ||||||||
| MPN114 | MPN397 | ||||||||
| MPN114-KO | MPN420 | ||||||||
| MPN159-KO | MPN428 | ||||||||
| MPN162-KO | MPN429 | ||||||||
| MPN194 | MPN430 | ||||||||
| MPN244 | MPN473 | ||||||||
| MPN246 | MPN475 | ||||||||
| MPN246 | MPN487 | ||||||||
| MPN250 | MPN506 | ||||||||
| MPN250 | MPN547 | ||||||||
| MPN255 | MPN566 | ||||||||
| MPN273 | MPN576 | ||||||||
| MPN302 | MPN606 | ||||||||
| MPN302 | MPN608 | ||||||||
| MPN303 | MPN615 | ||||||||
| MPN303 | MPN627 | ||||||||
| MPN303 | MPN629 | ||||||||
| MPN303 | MPN634 | ||||||||
| MPN348 | MPN667 | ||||||||
| MPN348 | MPN673 | ||||||||
| MPN397-KO | MPN674 | ||||||||
| MPN397-KO | |||||||||
| MPN420-KO | |||||||||
| MPN420-KO | |||||||||
| MPN420-KO | |||||||||
| MPN420-KO | |||||||||
| MPN428 | |||||||||
| MPN428 | |||||||||
| MPN428 | |||||||||
| MPN429 | |||||||||
| MPN429 | |||||||||
| MPN430 | |||||||||
| MPN430 | |||||||||
| MPN473 | |||||||||
| MPN475 | |||||||||
| MPN487 | |||||||||
| MPN506-KO | |||||||||
| MPN547 | |||||||||
| MPN566 | |||||||||
| MPN566-KO | |||||||||
| MPN576 | |||||||||
| MPN606 | |||||||||
| MPN606 | |||||||||
| MPN608 | |||||||||
| MPN608 | |||||||||
| MPN615 | |||||||||
| MPN627 | |||||||||
| MPN627 | |||||||||
| MPN627 | |||||||||
| MPN629 | |||||||||
| MPN629 | |||||||||
| MPN634 | |||||||||
| MPN667 | |||||||||
| MPN673 | |||||||||
| MPN674 | |||||||||
| MPN674 | |||||||||
| MPN674-KO | |||||||||
| MPN674-KO | |||||||||
| MPN674-KO | |||||||||
| MPN674-KO | |||||||||
| MPN674-KO, NoxE OE | |||||||||
| Tetracicline | |||||||||
