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Return to study ST001153 main page
Analysis: GC UNSPECIFIED ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
10-heptadecenoate (17:1n7)
10Z-Heptadecenoic acid
ME274497
5312435
-
5558
-
10-nonadecenoate (19:1n9)
Nonadeca-10Z-enoic acid
ME274498
5312513
-
5775
-
12-HEPE
12-HEPE
ME274469
10041593
-
5236
-
12-HETE
12-HETE
ME274470
-
-
5295
-
1,2-propanediol
1,2-Propanediol
ME274495
-
C00717,C02912,C00583,C01506,C02917
1041
-
13-HODE + 9-HODE
HODE
ME274485
-
-
5247
-
1,5-anhydroglucitol (1,5-AG)
1,5-Anhydrosorbitol
ME274430
-
C07326
1788.7
-
17-methylstearate
Xi-17-Methyloctadecanoic acid
ME274482
3083779
-
5987
-
1-arachidonoylglycerophosphocholine
LPC 20:4/0:0
ME274512
-
C05208
5554
-
1-arachidonoylglycerophosphoethanolamine
LPE 20:4
ME274513
-
-
5731
-
1-arachidonoylglycerophosphoinositol
LPI 20:4
ME274514
-
-
5479
-
1-docosahexaenoylglycerophosphocholine
-
ME274515
-
-
5518
-
1-linoleoylglycerophosphocholine
LPC 18:2
ME274516
11988421
C04100
5574
-
1-linoleoylglycerophosphoethanolamine
LPE 18:2
ME274517
-
-
5725
-
1-oleoylglycerophosphocholine
LPC 18:1/0:0
ME274518
16081932
-
5700
-
1-oleoylglycerophosphoethanolamine
LPE 18:1
ME274519
9547071
-
5928
-
1-oleoylglycerophosphoserine
LPS 18:1/0:0
ME274520
9547099
-
5690
-
1-palmitoleoylglycerophosphocholine
-
ME274521
-
-
5524
-
1-palmitoylglycerophosphocholine
LPC 16:0/0:0
ME274522
86554
-
5671
-
1-palmitoylglycerophosphoethanolamine
LPE 16:0
ME274523
9547069
-
5940
-
1-palmitoylglycerophosphoinositol
LPI 16:0
ME274524
-
-
5573
-
1-palmitoylplasmenylethanolamine
LPE P-16:0 or LPE O-16:1
ME274525
-
-
6153
-
1-stearoylglycerol (1-monostearin)
MG 18:0/0:0/0:0
ME274541
24699
D01947
2186.6
-
1-stearoylglycerophosphocholine
LPC 18:0/0:0
ME274526
497299
-
5844
-
1-stearoylglycerophosphoethanolamine
LPE 18:0/0:0
ME274527
9547068
-
6200
-
1-stearoylglycerophosphoinositol
LPI 18:0/0:0
ME274528
-
-
5800
-
2,3-diphosphoglycerate
2,3-Diphosphoglyceric acid
ME274431
186004
C01159
1970.7
-
2-(4-hydroxyphenyl)propionate
4-Hydroxyphenyl-2-propionic acid
ME274388
102526
C03080
1635
-
2-aminoadipate
alpha-Aminoadipic acid
ME274384
469
C00956
1686.5
-
2-aminobutyrate
2-Aminobutyric acid
ME274360
-
C02261
1215.7
-
2-arachidonoylglycerophosphoethanolamine
LPE 20:4
ME274529
-
-
5525
-
2-docosahexaenoylglycerophosphoethanolamine
LPE 22:6
ME274530
-
-
5512
-
2-hydroxybutyrate (AHB)
2-Hydroxybutyric acid
ME274363
440864
C05984
1169.4
-
2-hydroxystearate
2-Hydroxystearic acid
ME274486
69417
C03045
5705
-
2-linoleoylglycerophosphocholine
LPC 18:2
ME274531
-
-
5544
-
2-methylbutyroylcarnitine
CAR 4:0;2Me
ME274412
6426901
-
2439
-
2-oleoylglycerophosphoethanolamine
LPE 18:1
ME274532
-
-
5848
-
2-palmitoylglycerophosphocholine
LPC 0:0/16:0
ME274533
-
-
5604
-
2-palmitoylglycerophosphoethanolamine
LPE 16:0
ME274534
-
-
5790
-
3-(4-hydroxyphenyl)lactate
Hydroxyphenyllactic acid
ME274389
9378
C03672
1395
-
3-dehydrocarnitine*
3-Dehydrocarnitine
ME274462
6991982
C02636
1020
-
3-hydroxybutyrate (BHBA)
3-Hydroxybutyric acid
ME274496
441
C01089
1203.5
-
3-indoxyl sulfate
Indoxyl sulfate
ME274398
10258
-
2258
-
3-methyl-2-oxobutyrate
Ketoisovaleric acid
ME274413
49
C00141
1489
-
3-methyl-2-oxovalerate
3-Methyl-2-oxovaleric acid
ME274414
47
C00671
2106
-
3-phenylpropionate (hydrocinnamate)
Hydrocinnamic acid
ME274390
-
C05629
2830
-
3-phosphoglycerate
3-Phosphoglyceric acid
ME274432
-
C00597
1756
-
4-methyl-2-oxopentanoate
Ketoleucine
ME274415
70
C00233
2200
-
5-methylthioadenosine (MTA)
5'-Methylthioadenosine
ME274396
439176
C00170
2427
-
5-oxoproline
Pyroglutamic acid
ME274371
7405
C01879
1446
-
acetylcarnitine
CAR 2:0
ME274463
7045767
C02571
1203
-
acetylphosphate
Acetylphosphate
ME274453
186
C00227
1263
-
adenosine 5'-diphosphate (ADP)
ADP
ME274547
6022
C00008
800
-
adenosine 5'diphosphoribose
ADP-ribose
ME274442
4475880
C00301
964
-
adenosine 5'-monophosphate (AMP)
AMP
ME274548
15938965
C00020
1210
-
adrenate (22:4n6)
Adrenic acid
ME274499
5282844
C16527
5684
-
alanine
Alanine
ME274357
-
C00041
1147.6
-
alanylalanine
Ala-Ala
ME274556
-
C00993
1379.5
-
allantoin
Allantoin
ME274550
204
C02350
740
-
alpha-hydroxyisovalerate
2-Hydroxy-3-methylbutyric acid
ME274416
99823
-
1208
-
alpha-muricholate
alpha-Muricholic acid
ME274456
3083761
C17647
4763
-
alpha-tocopherol
alpha-Tocopherol
ME274446
14985
C02477
2305.4
-
arachidonate (20:4n6)
Arachidonic acid
ME274500
444899
C00219
5525
-
arginine
Arginine
ME274404
-
C00062
1608.5
-
azelate (nonanedioate)
Azelaic acid
ME274484
2266
C08261
1322
-
benzoate
Benzoic acid
ME274563
243
C00180
1291.5
-
beta-alanine
beta-Alanine
ME274358
-
C00099
1451.8
-
beta-hydroxyisovalerate
3-Hydroxyisovaleric acid
ME274417
69362
-
1043
-
betaine
Betaine
ME274376
247
-
721
-
butyrylcarnitine
CAR 4:0
ME274478
213144
-
2007
-
butyrylglycine
N-Butyrylglycine
ME274479
88412
-
2077
-
campesterol
Campesterol
ME274543
173183
C01789
2353
-
caprate (10:0)
Capric acid
ME274535
2969
C01571
5092
-
caproate (6:0)
Caproic acid
ME274536
8892
C01585
2766
-
caprylate (8:0)
Caprylic acid
ME274537
379
C06423
4367
-
carnitine
Carnitine
ME274464
10917
-
702
-
C-glycosyltryptophan
C-Glycosyltryptophan
ME274399
-
-
1912
-
chiro-inositol
1D-chiro-Inositol
ME274492
-
-
1857
-
cholate
Cholic acid
ME274457
-
C00695
5148
-
cholesterol
Cholesterol
ME274544
6432564
C00187
2316.9
-
choline
Choline
ME274487
170746
-
674
-
cinnamoylglycine
Cinnamoylglycine
ME274570
709625
-
3139
-
cis-aconitate
cis-Aconitic acid
ME274447
643757
C00417
603
-
citrate
Citric acid
ME274448
311
C00158
1763.4
-
citrulline
Citrulline
ME274405
833
C00327
715
-
creatine
Creatine
ME274361
586
C00300
758
-
creatinine
Creatinine
ME274362
588
C00791
730
-
cysteine
Cysteine
ME274364
-
C00097
1560.1
-
cysteine-glutathione disulfide
S-Glutathionyl-cysteine
ME274372
4247235
-
821
-
deoxycarnitine
3-Dehydroxycarnitine
ME274465
725
C01181
759
-
dihomo-linoleate (20:2n6)
11Z,14Z-Eicosadienoic acid
ME274501
6439848
C16525
5722
-
dihomo-linolenate (20:3n3 or n6)
Dihomo-gamma-linolenic acid
ME274471
5312529
C03242
5600
-
dihydroxyacetone phosphate (DHAP)
Dihydroxyacetone phosphate
ME274433
4643300
C00111
1737
-
dimethylglycine
Dimethylglycine
ME274377
-
C01026
1030
-
docosahexaenoate (DHA; 22:6n3)
DHA
ME274472
445580
C06429
5518
-
docosapentaenoate (n3 DPA; 22:5n3)
DPA
ME274473
-
C16513
5574
-
EDTA
Edetic acid
ME274569
-
C00284
611
-
eicosapentaenoate (EPA; 20:5n3)
EPA
ME274474
446284
C06428
5442
-
eicosenoate (20:1n9 or 11)
cis-Gondoic acid
ME274502
-
-
5955
-
ergothioneine
Ergothioneine
ME274571
3032311
C05570
847
-
erythritol
Erythritol
ME274574
-
C00503
1517.5
-
erythronate
Erythronic acid
ME274426
2781043
-
1546.9
-
ethanolamine
Ethanolamine
ME274488
-
C00189
1304
-
fructose
Fructose
ME274428
5984
C00095
1758
-
fumarate
Fumaric acid
ME274449
-
C00122
1382.1
-
gamma-glutamylisoleucine
gamma-Glutamylisoleucine
ME274557
-
-
2644
-
gamma-glutamylleucine
gamma-Glutamylleucine
ME274558
151023
-
2744
-
gamma-glutamylphenylalanine
gamma-Glutamylphenylalanine
ME274559
111299
-
2846
-
gamma-glutamylthreonine
gamma-Glutamylthreonine
ME274560
-
-
977
-
gamma-glutamyltyrosine
gamma-Glutamyltyrosine
ME274561
94340
-
2073
-
gamma-glutamylvaline
gamma-Glutamylvaline
ME274562
-
-
2040
-
glucose
Glucose
ME274434
79025
C00293
1866.8
-
glutamate
Glutamic acid
ME274369
611
C00025
700
-
glutamine
Glutamine
ME274370
-
C00064
684
-
glutathione, oxidized (GSSG)
Oxidized glutathione
ME274373
-
C00127
1535
-
glutathione, reduced (GSH)
Glutathione
ME274374
124886
C00051
1274
-
glycerate
Glyceric acid
ME274435
752
C00258
1360.7
-
glycerol 2-phosphate
sn-Glycero-2-phosphate
ME274565
2526
C02979,D01488
1691.8
-
glycerol 3-phosphate (G3P)
sn-Glycero-3-phosphate
ME274489
754
C00093
1719.7
-
glycerophosphorylcholine (GPC)
sn-Glycero-3-phosphocholine
ME274490
657272
C00670
694
-
glycine
Glycine
ME274378
-
C00037
1166
-
glycolate (hydroxyacetate)
Glycolic acid
ME274566
-
C00160
1119
-
guanosine 5'- monophosphate (5'-GMP)
GMP
ME274549
761
-
1300
-
heme
Heme
ME274441
-
-
4985
-
heptanoate (7:0)
Heptylic acid
ME274538
8094
C17714
3695
-
hexanoylcarnitine
CAR 6:0
ME274466
6426853
C01585
3174
-
hexanoylglycine
Hexanoylglycine
ME274477
99463
-
3614
-
hippurate
Hippuric acid
ME274564
464
C01586
2136
-
histidine
Histidine
ME274383
-
C00135
757
-
homocitrulline
Homocitrulline
ME274406
-
C02427
832
-
homocysteine
Homocysteine
ME274365
778
C00155
1648.2
-
homostachydrine
(S)-Homostachydrine
ME274572
441447
C08283
1199
-
hydroxyisovaleroyl carnitine
CAR 4:0;OH,Me
ME274418
-
-
1683
-
iminodiacetate (IDA)
Iminodiacetate
ME274567
8897
-
1538.8
-
inosine 5'-monophosphate (IMP)
IMP
ME274546
7140378
C00130
1310
-
Isobar: 2-propylpentanoic acid, 2-ethylhexanoic ac...
Valproic acid
ME274568
-
-
3909
-
Isobar: fructose 1,6-diphosphate, glucose 1,6-diph...
DHA
ME274436
-
-
572
-
isobutyrylcarnitine
CAR 3:0;2Me
ME274419
-
-
1941
-
isoleucine
Isoleucine
ME274420
791
C00407
1614
-
isovalerylcarnitine
CAR 4:0;3Me
ME274421
6426851
-
2533
-
isovalerylglycine
Isovalerylglycine
ME274422
546304
-
2665
-
kynurenine
Kynurenine
ME274400
-
C00328
1902
-
lactate
Lactic acid
ME274437
612
C00186
1102.8
-
laurate (12:0)
Lauric acid
ME274539
3893
C02679
5288
-
leucine
Leucine
ME274423
-
C00123
1674
-
linoleate (18:2n6)
Linoleic acid
ME274475
5280450
C01595
5533
-
linolenate [alpha or gamma; (18:3n3 or 6)]
Octadecatrienoic acid
ME274476
-
C06427
5450
-
lysine
Lysine
ME274385
5962
C00047
1836.7
-
malate
Malic acid
ME274450
525
C00149
1502
-
malonylcarnitine
CAR DC3:0
ME274481
-
-
980
-
mannose
Mannose
ME274429
161658
C00159
1753.5
-
margarate (17:0)
Margaric acid
ME274503
10465
-
5733
-
methionine
Methionine
ME274366
-
C00073
1252
-
methyl palmitate (15 or 2)
-
ME274483
-
-
5698
-
methylphosphate
Methanolphosphate
ME274545
13130
-
1221
-
myo-inositol
Myo-inositol
ME274493
-
C00137
1924.9
-
myristate (14:0)
Myristic acid
ME274504
11005
C06424
5439
-
myristoleate (14:1n5)
Myristoleic acid
ME274505
5281119
C08322
5338
-
N-6-trimethyllysine
N-6-Trimethyllysine
ME274386
159659
-
650
-
N-acetyl-beta-alanine
N-Acetyl-beta-alanine
ME274359
76406
C01073
1460
-
N-acetylglycine
N-Acetylglycine
ME274379
10972
-
1396.4
-
N-acetylleucine
N-Acetylleucine
ME274424
70912
C02710
3444
-
N-acetylmethionine
N-Acetylmethionine
ME274367
448580
C02712
1805
-
N-acetylneuraminate
N-Acetylneuraminic acid
ME274427
-
C00270
2074.9
-
N-acetylornithine
N-Acetylornithine
ME274407
-
C00437
875
-
N-acetylphenylalanine
N-Acetylphenylalanine
ME274391
74839
C03519
3563
-
N-acetyltryptophan
N-Acetyl-tryptophan
ME274401
700653
C03137
2650
-
nicotinamide
Niacinamide
ME274443
936
C00153
1267
-
nonadecanoate (19:0)
Nonadecylic acid
ME274506
12591
C16535
6073
-
octanoylcarnitine
CAR 8:0
ME274467
123701
-
4100
-
oleate (18:1n9)
Oleic acid
ME274507
445639
C00712
5660
-
oleoylcarnitine
CAR 18:1
ME274468
-
-
5202
-
ophthalmate
Ophthalmic acid
ME274375
9817431
-
1457
-
ornithine
Ornithine
ME274408
6262
C00077
1763.8
-
orotate
Orotic acid
ME274552
967
C00295
1709.6
-
palmitate (16:0)
Palmitic acid
ME274508
985
C00249
5619
-
palmitoleate (16:1n7)
Palmitoleic acid
ME274509
445638
C08362
5477
-
palmitoyl sphingomyelin
SM 18:1;O2/16:0
ME274542
9939941
-
2524
-
pantothenate
Pantothenic acid
ME274445
6613
C00864
2218
-
pelargonate (9:0)
Pelargonic acid
ME274540
5461016
C01601
4847
-
phenol sulfate
Phenyl hydrogen sulfate
ME274392
74426
C02180
2199
-
phenylacetylglycine
Phenylacetylglycine
ME274393
68144
C05598
2377
-
phenylalanine
Phenylalanine
ME274394
-
C00079
2056
-
phosphate
Phosphoric acid
ME274454
1061
C00009
1307.7
-
phosphoenolpyruvate (PEP)
Phosphoenolpyruvic acid
ME274438
1005
C00074
1595.4
-
phosphoethanolamine
Phosphoethanolamine
ME274491
-
C00346
1577.3
-
pinitol
Pinitol
ME274494
-
C03844
1773
-
pipecolate
Pipecolic acid
ME274387
849
C00408
1120
-
proline
Proline
ME274409
-
C00148
796
-
propionylcarnitine
CAR 3:0
ME274480
107738
C03017
1589
-
pseudouridine
Pseudouridine
ME274553
-
C02067
1104
-
pyrophosphate (PPi)
Pyrophosphate
ME274455
644102
C00013
1642.3
-
pyruvate
Pyruvic acid
ME274439
107735
C00022
1130.6
-
sarcosine (N-Methylglycine)
Sarcosine
ME274380
-
C00213
1182.9
-
serine
Serine
ME274381
-
C00065
1389.1
-
serotonin (5HT)
Serotonin
ME274402
5202
C00780
1660
-
spermidine
Spermidine
ME274397
1102
C00315
533
-
stachydrine
Stachydrine
ME274573
115244
C10172
860
-
stearate (18:0)
Stearic acid
ME274510
5281
C01530
5886
-
stearidonate (18:4n3)
Stearidonic acid
ME274511
5312508
C16300
5381
-
succinate
Succinic acid
ME274451
1110
C00042
618
-
succinylcarnitine
CAR DC4:0
ME274452
-
-
1401
-
taurine
Taurine
ME274368
-
C00245
1616.4
-
tauro-beta-muricholate
Tauro-beta-muricholic acid
ME274458
168408
-
4763
-
taurocholate
Taurocholic acid
ME274459
-
C05122
5122
-
taurodeoxycholate
Taurodeoxycholic acid
ME274460
2733768
C05463
5243
-
tauroursodeoxycholate
Tauroursodeoxycholic acid
ME274461
-
-
5002.6
-
threonate
Threonic acid
ME274440
151152
C01620
1560.7
-
threonine
Threonine
ME274382
-
C00188
713
-
trans-4-hydroxyproline
trans-4-Hydroxyproline
ME274410
-
C01157
1537
-
trigonelline (N'-methylnicotinate)
Trigonelline
ME274444
5570
-
757
-
tryptophan
Tryptophan
ME274403
-
C00078
2445
-
tyrosine
Tyrosine
ME274395
-
C00082
1516
-
uracil
Uracil
ME274554
1174
C00106
1370.4
-
urate
Uric acid
ME274551
-
C00366
1928
-
urea
Urea
ME274411
-
C00086
1223.9
-
uridine
Uridine
ME274555
6029
C00299
1467
-
valine
Valine
ME274425
-
C00183
1040
-
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