Selected Cell
Cell:
Value:
Gut_Pos
A
B
C
D
E
F
G
H
I
J
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
| Compound | Accepted Compound ID | Formula | Adducts | Score | Fragmentation Score | Mass Error (ppm) | Isotope Similarity | ||
| 0.59_369.3513m/z | Sterol lipid | ||||||||
| 0.82_696.5828n | CE 22:6 | C49H76O2 | M+NH4, M+Na | 57.8 | 99.8 | -2.47701188852592 | 92.2940241501661 | ||
| 0.84_722.6406n | TG 42:0 | C45H86O6 | M+NH4, M+Na | 37.5 | 0 | -2.49312746185187 | 90.2285175774219 | ||
| 0.86_750.6731n | TG 44:0 | C47H90O6 | M+NH4, M+Na | 38.3 | 0 | -0.81509445407464 | 92.3658624751872 | ||
| 0.87_748.6569n | TG 44:1 | C47H88O6 | M+NH4, M+Na | 51.2 | 71.9 | -1.53627213451952 | 85.7447442491179 | ||
| 0.88_780.7064m/z | TG 45:1 | C48H90O6 | M+NH4 | 55.5 | 94.3 | -1.46499570487763 | 84.9730594478376 | ||
| 0.89_776.6889n | TG 46:1 | C49H92O6 | M+H, M+NH4, M+Na | 51.3 | 95.8 | -0.633875642551153 | 61.674135344943 | ||
| 0.89_790.7039n | TG 47:1 | C50H94O6 | M+NH4, M+Na | 40.4 | 35.7 | -1.41377906213928 | 68.2014903973031 | ||
| 0.90_792.7067m/z | TG 46:2 | C49H90O6 | M+NH4 | 36.7 | 0 | -1.08369946105885 | 85.0129825339143 | ||
| 0.90_804.7204n | TG 48:1 | C51H96O6 | M+NH4, M+Na | 52.8 | 88.4 | -0.39854281065042 | 76.3403178683008 | ||
| 0.90_806.7224m/z | TG 47:2 | C50H92O6 | M+NH4 | 47.8 | 56.7 | -1.0702917388569 | 83.5069731558904 | ||
| 0.90_818.7352n | TG 49:1 | C52H98O6 | M+NH4, M+Na | 54.9 | 90.2 | -1.41128559387954 | 85.7621331009252 | ||
| 0.91_772.6551n | TG 46:3 | C49H88O6 | M+H, M+NH4 | 36.1 | 0.059 | -3.92510425722303 | 84.8031363451665 | ||
| 0.91_820.7385m/z | TG 48:2 | C51H94O6 | M+NH4 | 38.7 | 8.91 | -0.451337286113615 | 85.2311892053408 | ||
| 0.91_832.7508n | TG 50:1 | C53H100O6 | M+NH4, M+Na | 54.1 | 82.4 | -1.39875122672703 | 89.9426881281294 | ||
| 0.92_800.6891n | TG 48:3 | C51H92O6 | M+H, M+NH4, M+Na | 53.9 | 83.9 | -0.412359290205274 | 86.0354304119064 | ||
| 0.92_834.7541m/z | TG 49:2 | C52H96O6 | M+NH4 | 50.2 | 68.6 | -0.559805824979386 | 83.2254523559712 | ||
| 0.93_816.7074m/z | TG 48:4 | C51H90O6 | M+NH4 | 37.1 | 1.74 | -0.245455273660554 | 84.2077048023952 | ||
| 0.93_832.7383m/z | TG 49:3 | C52H94O6 | M+NH4 | 40.3 | 14.4 | -0.65420380240538 | 87.639344404828 | ||
| 0.93_858.7669n | TG 52:2 | C55H102O6 | M+NH4, M+Na | 50 | 76.5 | -0.889754512354325 | 74.8404239799272 | ||
| 0.93_862.7850m/z | TG 51:2 | C54H100O6 | M+NH4 | 41.6 | 47.4 | -0.989596514764733 | 61.8529043500954 | ||
| 0.93_883.7727m/z | TG 52:1 | C55H104O6 | M+Na | 46.9 | 45.9 | 0.262059409814114 | 89.0011748939034 | ||
| 0.94_814.6915m/z | TG 48:5 | C51H88O6 | M+NH4 | 37.1 | 0.0821 | -0.513696300033455 | 85.8716023148091 | ||
| 0.94_890.8155m/z | TG 53:2 | C56H104O6 | M+NH4 | 51.6 | 79.4 | -1.89644522705241 | 80.631977283151 | ||
| 0.95_826.7029n | TG 50:4 | C53H94O6 | M+H, M+NH4 | 39.3 | 13.6 | -2.54312016235684 | 85.8287187597156 | ||
| 0.95_886.7978n | TG 54:2 | C57H106O6 | M+NH4, M+Na | 47.7 | 56 | -1.26797076839995 | 83.9879427954149 | ||
| 0.95_918.8460m/z | TG 55:2 | C58H108O6 | M+NH4 | 45.7 | 44.3 | -2.72663474469551 | 87.3872189893994 | ||
| 0.96_429.3722m/z | Sterol lipid | ||||||||
| 0.96_824.6884n | TG 50:5 | C53H92O6 | M+H, M+NH4 | 51.9 | 75.1 | -1.25784387920826 | 86.0044884362024 | ||
| 0.96_914.8289n | TG 56:2 | C59H110O6 | M+NH4, M+Na | 47.9 | 47.9 | -1.48489854794747 | 93.4781564840499 | ||
| 0.96_916.8308m/z | TG 55:3 | C58H106O6 | M+NH4 | 42.2 | 31.6 | -2.13332859073985 | 81.7198350008815 | ||
| 0.97_840.7081m/z | TG 50:6 | C53H90O6 | M+NH4 | 37.4 | 2.44 | 0.653549607342898 | 85.2794850392339 | ||
| 0.97_852.7185n | TG 52:5 | C55H96O6 | M+H, M+Na | 42.3 | 29 | -2.58719588837512 | 85.6334567737417 | ||
| 0.97_965.8468m/z | TG 58:2 | C61H114O6 | M+Na | 37.1 | 3.41 | -4.15613218227057 | 87.1230055698697 | ||
| 0.98_838.6935m/z | TG 50:7 | C53H88O6 | M+NH4 | 38.3 | 7.2 | 1.94281412491133 | 86.4325788213366 | ||
| 0.98_880.7505n | TG 54:5 | C57H100O6 | M+H, M+NH4, M+Na | 43.3 | 52.2 | -1.65852501782412 | 66.459165379247 | ||
| 0.98_958.8787m/z | TG 58:3 | C61H112O6 | M+NH4 | 40 | 37.1 | -1.031989170206 | 64.3594962553212 | ||
| 0.99_851.7117m/z | TG 50:3 | C53H96O6 | M+Na | 45 | 43.9 | 2.17926536557872 | 83.6070358687521 | ||
| 0.99_910.7855m/z | TG 55:6 | C58H100O6 | M+NH4 | 36 | 23 | -0.392362214217317 | 57.4295469094703 | ||
| 0.99_972.8923m/z | TG 59:3 | C62H114O6 | M+NH4 | 35.1 | 1.66 | -3.17632908356112 | 77.4979536464232 | ||
| 1.00_1000.9236m/z | TG 61:3 | C64H118O6 | M+NH4 | 38.5 | 13.8 | -3.08518979563791 | 82.1877100543257 | ||
| 1.00_864.7087m/z | TG 52:8 | C55H90O6 | M+NH4 | 37.4 | 2.72 | 1.29867220969811 | 85.9443709907989 | ||
| 1.00_879.7412m/z | TG 54:6 | C57H98O6 | M+H | 38.1 | 18.6 | -2.74721393966758 | 75.0323148474357 | ||
| 1.00_908.7712m/z | TG 55:7 | C58H98O6 | M+NH4 | 39.5 | 16.7 | 1.15964154032348 | 82.0966051364502 | ||
| 1.00_922.7861m/z | TG 56:7 | C59H100O6 | M+NH4 | 41.6 | 41.2 | 0.268919074329756 | 66.9910007294893 | ||
| 1.00_926.8155m/z | TG 56:5 | C59H104O6 | M+NH4 | 43.6 | 61 | -1.77027366853029 | 59.0560266683889 | ||
| 1.00_986.9107m/z | TG 60:3 | C63H116O6 | M+NH4 | 41 | 26.1 | -0.361756280157255 | 79.3163033221729 | ||
| 1.01_1014.9417m/z | TG 62:3 | C65H120O6 | M+NH4 | 43 | 19.5 | -0.623508388990089 | 96.0619146947077 | ||
| 1.01_877.7272m/z | TG 54:7 | C57H96O6 | M+H | 52 | 78.3 | -0.862273844065227 | 82.7450523130481 | ||
| 1.01_936.8013m/z | TG 57:7 | C60H102O6 | M+NH4 | 35.9 | 19.3 | -0.191841011240107 | 60.2213492904299 | ||
| 1.01_954.8462m/z | TG 58:5 | C61H108O6 | M+NH4 | 34.9 | 15.7 | -2.34772721389438 | 61.6978275800288 | ||
| 1.02_1042.9731m/z | TG 64:3 | C67H124O6 | M+NH4 | 41.4 | 13.3 | -0.480367350965364 | 94.2479001868058 | ||
| 1.02_705.5815m/z | Sterol lipid | ||||||||
| 1.02_875.7128m/z | TG 54:8 | C57H94O6 | M+H | 39.8 | 15.7 | 0.52 | 83.7174120466087 | ||
| 1.02_978.8483m/z | TG 60:7 | C63H108O6 | M+NH4 | 50.8 | 78.5 | -0.0809008671023297 | 75.6625645252961 | ||
| 1.03_1040.9530m/z | TG 64:4 | C67H122O6 | M+NH4 | 35.7 | 8.99 | -4.85659098601044 | 75.3498095157926 | ||
| 1.03_1071.0035m/z | TG 66:3 | C69H128O6 | M+NH4 | 37.6 | 1.12 | -1.30432624439632 | 88.4971288442642 | ||
| 1.03_890.7234m/z | TG 54:9 | C57H92O6 | M+NH4 | 44.1 | 37.5 | 0.212556664046998 | 83.1419067869058 | ||
| 1.03_918.7546m/z | TG 56:9 | C59H96O6 | M+NH4 | 40.3 | 19.3 | 0.107389204302135 | 82.1532415178728 | ||
| 1.03_962.8176m/z | TG 59:8 | C62H104O6 | M+NH4 | 47.3 | 54.4 | 0.488603105093621 | 82.9523430008622 | ||
| 1.03_976.8326m/z | TG 60:8 | C63H106O6 | M+NH4 | 45.7 | 48.6 | -0.147723110824374 | 80.1603892701765 | ||
| 1.04_888.7079m/z | TG 54:10 | C57H90O6 | M+NH4 | 38.5 | 8.67 | 0.407293112200209 | 84.3539627246892 | ||
| 1.04_916.7384m/z | TG 56:10 | C59H94O6 | M+NH4 | 38.6 | 11.5 | -0.552264317939718 | 81.9837992494762 | ||
| 1.04_990.8470m/z | TG 61:8 | C64H108O6 | M+NH4 | 41 | 28.1 | -1.41498873655845 | 78.4279864638369 | ||
| 1.04_992.8629m/z | TG 61:7 | C64H110O6 | M+NH4 | 42 | 43.1 | -1.15501591616556 | 68.4789726742061 | ||
| 1.05_1004.8638m/z | TG 62:8 | C65H110O6 | M+NH4 | 38.2 | 26.9 | -0.300326683225532 | 64.5486496084884 | ||
| 1.05_1020.8936m/z | TG 63:7 | C66H114O6 | M+NH4 | 37.2 | 3.25 | -1.76875147349424 | 84.6935218218573 | ||
| 1.06_1032.8947m/z | TG 64:8 | C67H114O6 | M+NH4 | 43.5 | 53.8 | -0.665240470550505 | 64.6318429192869 | ||
| 1.07_1060.9258m/z | TG 66:8 | C69H118O6 | M+NH4 | 39 | 14.4 | -0.823054930982063 | 81.3751103892339 | ||
| 1.07_914.7226m/z | TG 56:11 | C59H92O6 | M+NH4 | 40.6 | 20.4 | -0.663467749112247 | 83.316516002925 | ||
| 1.08_940.7387m/z | TG 58:12 | C61H94O6 | M+NH4 | 43.6 | 36.2 | -0.211654398520324 | 81.8750292366023 | ||
| 1.08_968.7728m/z | TG 60:12 | C63H98O6 | M+NH4 | 41 | 59.1 | 2.74017013355484 | 49.2879407410494 | ||
| 1.09_938.7239m/z | TG 58:13 | C61H92O6 | M+NH4 | 36.1 | 0 | 0.693941813417821 | 81.3228345388725 | ||
| 1.09_966.7536m/z | TG 60:13 | C63H96O6 | M+NH4 | 36 | 0 | -0.99666560309923 | 81.1666506184224 | ||
| 1.09_996.7997m/z | TG 62:12 | C65H102O6 | M+NH4 | 32.5 | 29.5 | -1.83631717412634 | 35.0931353328935 | ||
| 1.11_1024.8311m/z | TG 64:12 | C67H106O6 | M+NH4 | 35.2 | 29.7 | -1.6592561998523 | 48.4689680442884 | ||
| 1.11_992.7688m/z | TG 62:14 | C65H98O6 | M+NH4 | 41.1 | 25.7 | -1.36546457129 | 81.2314132412642 | ||
| 1.12_1050.8474m/z | TG 66:13 | C69H108O6 | M+NH4 | 41.3 | 59.1 | -1.00498433164616 | 48.7361267492502 | ||
| 1.16_1014.7544m/z | TG 64:17 | C67H96O6 | M+NH4 | 36.1 | 38.4 | -0.0753231710250308 | 42.3184995963658 | ||
| 1.17_910.7485m/z | Sterol lipid | ||||||||
| 1.18_1040.7699m/z | TG 66:18 | C69H98O6 | M+NH4 | 41.9 | 64.1 | -0.225751174838037 | 45.7051541265636 | ||
| 1.32_568.5051n | DG 32:0 | C35H68O5 | M+H-H2O, M+Na | 37.6 | 0 | -2.81181601690472 | 91.170664741088 | ||
| 1.33_566.4904n | DG 32:1 | C35H66O5 | M+H-H2O, M+NH4, M+Na | 37.5 | 0 | -1.09176790451278 | 89.0608330203691 | ||
| 1.35_594.5212n | DG 34:1 | C37H70O5 | M+H-H2O, M+NH4, M+Na | 55.9 | 97.4 | -1.89288002721986 | 84.4414331056072 | ||
| 1.37_643.5263m/z | DG 36:2 | C39H72O5 | M+Na | 29.2 | 0 | -1.50132244340952 | 47.6131402703413 | ||
| 1.38_590.4908n | DG 34:3 | C37H66O5 | M+H-H2O, M+H, M+NH4 | 38.7 | 25.3 | -0.348015543599918 | 68.8101905450666 | ||
| 1.39_618.5210n | DG 36:3 | C39H70O5 | M+H-H2O, M+NH4 | 35.6 | 2.69 | -2.19795919015205 | 77.8931947124506 | ||
| 1.40_676.5982n | DG 40:2 | C43H80O5 | M+H-H2O, M+NH4, M+Na | 39.1 | 5.17 | -3.51444624433745 | 94.4991767347293 | ||
| 1.41_614.4892n | DG 36:5 | C39H66O5 | M+H-H2O, M+H | 36.5 | 0 | -3.03413108353339 | 86.071353882227 | ||
| 1.41_616.5055n | DG 36:4 | C39H68O5 | M+H-H2O, M+H, M+Na | 33.5 | 0 | -1.9607861888872 | 69.7003648950716 | ||
| 1.41_644.5371n | DG 38:4 | C41H72O5 | M+H, M+NH4, M+Na | 35.6 | 15 | -1.43344620736364 | 64.5865999774844 | ||
| 1.43_640.5061n | DG 38:6 | C41H68O5 | M+H, M+NH4 | 44.6 | 33.6 | -0.85891702913898 | 90.3304850619312 | ||
| 1.44_877.7270m/z | Sterol lipid | ||||||||
| 1.45_668.5368n | DG 40:6 | C43H72O5 | M+H-H2O, M+H, M+NH4, M+Na | 37.6 | 11.4 | -1.8168862919436 | 78.8520496398988 | ||
| 1.46_666.5220n | DG 40:7 | C43H70O5 | M+H-H2O, M+H, M+NH4, M+Na | 41.4 | 20.8 | -0.503895904373259 | 86.6228305515864 | ||
| 1.47_694.5529n | DG 42:7 | C45H74O5 | M+H, M+NH4, M+Na | 53.8 | 89.5 | -1.06737407143772 | 80.7819464001123 | ||
| 1.49_722.5843n | DG 44:7 | C47H78O5 | M+H, M+NH4, M+Na | 58.5 | 99.3 | -0.889617388044666 | 94.3243332575554 | ||
| 1.63_330.2756n | MG 16:0 | C19H38O4 | M+H-H2O, M+Na | 37.6 | 0 | -4.11961405584865 | 92.6878558645658 | ||
| 1.65_358.3070n | MG 18:0 | C21H42O4 | M+H-H2O, M+Na | 37.6 | 0 | -3.72251494352629 | 92.2656926159394 | ||
| 2.12_647.6205n | Cer 42:2 | C42H81NO3 | M+H-2H2O, M+H-H2O, M+H, M+Na | 44 | 29.8 | -1.8312106727249 | 92.4804235894764 | ||
| 3.66_711.4174m/z | PG 30:3 | C36H65O10P | M+Na | 42.9 | 29.6 | 89.2993424496558 | |||
| 4.03_737.4993n | PE 36:5 | C41H72NO8P | M+H, M+Na | 43.7 | 35.6 | -0.393594993692929 | 83.3144083354449 | ||
| 4.04_763.5176n | PE 38:6 | C43H74NO8P | M+H, M+Na, M+2Na-H | 50.8 | 65.6 | 3.13377150384081 | 91.9510459099468 | ||
| 4.04_783.5405n | PE 38:4(OH) | C43H78NO9P | M+H-2H2O, M+Na | 45.1 | 43 | -1.19395749016601 | 83.9734837235896 | ||
| 4.05_774.5426m/z | PE P-40:7, PE O-40:8 | C45H76NO7P | M+H | 44.8 | 51.9 | -0.75248081359366 | 72.7783296393999 | ||
| 4.05_817.5613n | PE 42:7 | C47H80NO8P | M+H, M+Na | 41.2 | 18.9 | -0.988648837175986 | 88.4665383393881 | ||
| 4.06_789.5309n | PE 40:7 | C45H76NO8P | M+H, M+Na | 42.2 | 55.7 | 0.0182449409654755 | 55.3596382808708 | ||
| 4.08_787.5139n | PE 40:8 | C45H74NO8P | M+H, M+Na | 45.3 | 45.5 | -1.60152071582033 | 82.8553829873154 | ||
| 4.08_815.5453n | PE 42:8 | C47H78NO8P | M+H, M+Na | 41.7 | 26.9 | -1.44611977765465 | 83.140423234525 | ||
| 4.10_785.4994n | PE 40:9 | C45H72NO8P | M+H, M+Na | 47.6 | 53.9 | -0.228750954299412 | 84.3772840831231 | ||
| 4.82_777.5883n | PS O-36:0 | C42H84NO9P | M+H-H2O, M+Na | 38.4 | 0 | -0.151519025190226 | 92.1709670330989 | ||
| 4.83_706.5374m/z | PC 30:0 | C38H76NO8P | M+H | 38.1 | 0 | -0.969144276884712 | 91.5992763595138 | ||
| 4.83_758.5697m/z | PC 34:2 | C42H80NO8P | M+H | 45.2 | 39.9 | 0.362795728217615 | 86.6545900939394 | ||
| 4.83_787.5756n | PS P-37:1, PS O-37:2 | C43H82NO9P | M+H-H2O, M+Na | 32.9 | 0 | 3.65891990283938 | 68.7114455715391 | ||
| 4.83_860.6150m/z | PC 40:4 | C48H88NO8P | M+Na | 40.7 | 34.4 | 1.23104544450322 | 70.431654987813 | ||
| 4.83_888.6464m/z | PC 42:4 | C50H92NO8P | M+Na | 44.9 | 37.9 | 1.25350391818686 | 88.1765955844962 | ||
| 4.84_756.5534m/z | PC 34:3 | C42H78NO8P | M+H | 44.5 | 36.6 | -0.528856950645838 | 86.4158698468288 | ||
| 4.84_806.5704m/z | PC 38:6 | C46H80NO8P | M+H | 39.6 | 4.97 | 1.17379884156536 | 94.3119147176672 | ||
| 4.84_818.5912m/z | PS 38:1 | C44H84NO10P | M+H | 33.4 | 0 | 0.772948898499829 | 67.6997211342731 | ||
| 4.85_753.5293n | PC 34:4 | C42H76NO8P | M+H, M+Na | 39.1 | 12.5 | -2.06266634798195 | 85.5308019073618 | ||
| 4.85_780.5544m/z | PC 36:5 | C44H78NO8P | M+H | 36.9 | 5.56 | 0.762227050595553 | 80.0285735604682 | ||
| 4.86_752.5234m/z | PC 32:2 | C40H76NO8P | M+Na | 56.5 | 99.3 | 4.54062817559537 | 88.475820440315 | ||
| 4.86_778.5396m/z | PC 36:6 | C44H76NO8P | M+H | 40.7 | 19.9 | 1.89 | 85.75 | ||
| 4.86_804.5543m/z | PC 36:4 | C44H80NO8P | M+Na | 41.9 | 26.6 | 3.6837372828213 | 87.0729387502527 | ||
| 4.86_830.5688m/z | PC 38:5 | C46H82NO8P | M+Na | 40.4 | 20.7 | 2.20634744583637 | 84.069681012354 | ||
| 4.87_802.5372m/z | PC 38:8 | C46H76NO8P | M+H | 36.7 | 0 | -1.12 | 84.75 | ||
| 4.87_828.5528m/z | PC 40:9 | C48H78NO8P | M+H | 36.5 | 0 | -1.24 | 83.79 | ||
| 4.88_852.5540m/z | PC 42:11 | C50H78NO8P | M+H | 30.4 | 0 | 0.255382426810571 | 52.5172683849954 | ||
| 4.88_878.5699m/z | PC 42:9 | C50H82NO8P | M+Na | 39.8 | 10.6 | 3.3283702805577 | 92.1407126469837 | ||
| 5.00_812.6767n | SM 42:2 | C47H93N2O6P | M+H, M+Na | 58.2 | 99.5 | -0.528596502360282 | 91.9955327805312 | ||
| 5.04_703.5739m/z | SM 34:1 | C39H79N2O6P | M+H | 37.8 | 0 | -1.3394821052422 | 90.6784783977232 | ||
| 5.05_675.5430m/z | SM 32:1 | C37H75N2O6P | M+H | 38.2 | 0 | -0.834704994153151 | 91.9798102892934 | ||
| 5.05_741.5897m/z | SM 35:0 | C40H83N2O6P | M+Na | 57.9 | 99.3 | 2.17579410492096 | 92.5912821633468 | ||
| 5.13_496.3391m/z | LPC 16:0 | C24H50NO7P | M+H | 58 | 99.6 | -1.29590565204179 | 92.1995703711826 |
