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Return to study ST000061 main page
Analysis: GCMS positive ion mode
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
tocopherol beta NIST
beta-tocopherol
ME652402
8989
C14152
1022815
223
tocopherol gamma-
gamma-Tocopherol
ME652403
92729
C02483
1026121
223
adenosine-5-monophosphate
AMP
ME652298
6083
C00020
1038688
169
tocopherol alpha-
alpha-Tocopherol
ME652401
638015
C00376
1067809
237
cholesterol
Cholesterol
ME652313
5997
C00187
1078536
329
maltotriose
Maltotriose
ME652362
439586
C01835
1176044
361
pyruvic acid
Pyruvic acid
ME652387
1060
C00022
211668
174
propane-1,3-diol NIST
Propane-1,3-diol
ME652383
10442
C02457
214380
177
glycolic acid
Glycolic acid
ME652340
757
C00160
227636
177
acetophenone NIST
Acetophenone
ME652296
7410
C07113
238615
105
alanine
Alanine
ME652300
5950
C00041
243971
116
hydroxylamine
Hydroxylamine
ME652348
787
C00192
253158
146
2-hydroxybutanoic acid
2-Hydroxybutyric acid
ME652290
11266
C05984
259536
131
oxalic acid
Oxalic acid
ME652373
971
C00209
260513
190
lactamide
Lactamide
ME652354
94220
-
265698
232
3-hydroxybutyric acid
3-Hydroxybutyric acid
ME652293
441
C01089
278829
191
p-cresol
P-Cresol
ME652377
2879
C01468
280360
165
sulfuric acid
TG 16:0_18:1_18:1
ME652397
5462417
C00059
282411
227
N-methylalanine
N-Methylalanine
ME652368
5288725
C02721
286855
130
2-ketoisocaproic acid
Ketoleucine
ME652292
70
C00233
310761
89
valine
Valine
ME652413
6287
C00183
313502
144
hydroxycarbamate NIST
Hydroxycarbamic acid
ME652347
16639161
-
325948
278
pyrophosphate
Pyrophosphate
ME652386
644102
C00013
326948
110
urea
Urea
ME652410
1176
C00086
328888
189
benzoic acid
Benzoic acid
ME652309
243
C00180
339214
179
caprylic acid
Caprylic acid
ME652312
379
C06423
343457
201
glycerol
Glycerol
ME652337
753
C00116
344466
205
ethanolamine
Ethanolamine
ME652326
700
C00189
344719
174
leucine
Leucine
ME652356
6106
C00123
346101
158
epsilon-caprolactam
Epsilon-caprolactam
ME652324
7768
C06593
353069
170
isoleucine
Isoleucine
ME652352
6306
C00407
359251
158
proline
Proline
ME652382
145742
C00148
364716
142
glycine
Glycine
ME652339
750
C00037
368707
248
succinic acid
Succinic acid
ME652395
1110
C00042
370608
247
2,3-dihydroxypyridine
2,3-Dihydroxypyridine
ME652288
28115
-
373895
240
glyceric acid
Glyceric acid
ME652336
439194
C00258
377495
189
uracil
Uracil
ME652409
1174
C00106
385735
241
fumaric acid
Fumaric acid
ME652329
444972
C00122
390016
245
2-deoxytetronic acid NIST
3,4-Dihydroxybutyric acid
ME652289
192742
-
390517
117
serine
Serine
ME652390
5951
C00065
395020
218
2,5-dihydroxypyrazine NIST
2,5-Dihydroxypyrazine
ME652283
23368901
-
397526
241
pelargonic acid
Pelargonic acid
ME652378
8158
C01601
399229
117
salicylaldehyde
2-Hydroxybenzaldehyde
ME652389
6998
C06202
406586
119
threonine
Threonine
ME652400
6288
C00188
409568
218
glutaric acid
Glutaric acid
ME652335
743
C00489
421260
261
beta-alanine
beta-Alanine
ME652310
239
C00099
435564
248
capric acid
Capric acid
ME652311
2969
C01571
451790
229
aminomalonate
Aminomalonic acid
ME652302
100714
C00872
455754
218
trans-4-hydroxyproline
trans-4-Hydroxyproline
ME652404
11137200
C01157
460061
158
malic acid
Malic acid
ME652360
222656
C00711
463180
233
nicotinamide
Niacinamide
ME652367
936
C00153
471602
179
erythritol
Erythritol
ME652325
222285
C00503
471922
217
adipic acid
Adipic acid
ME652299
196
C06104
474435
111
aspartic acid
Aspartic acid
ME652306
5960
C00049
480387
232
methionine
Methionine
ME652364
6137
C00073
483560
176
oxoproline
Oxoproline
ME652374
7405
C01879
485935
156
isothreonic acid 1
D-Threonic acid
ME652353
5280363
C00639
489385
292
threonic acid
Threonic acid
ME652399
151152
C01620
497572
292
cysteine
Cysteine
ME652319
594
C00097
500158
220
creatinine
Creatinine
ME652318
588
C00791
502599
115
2-hydroxyglutaric acid
2-Hydroxyglutaric acid
ME652291
43
C02630
506306
247
alpha-ketoglutarate
2-Oxoglutaric acid
ME652301
51
C00026
507392
198
dodecanol
Dodecanol
ME652323
8193
C02277
507619
243
ornithine
Ornithine
ME652372
6262
C00077
527113
142
glutamic acid
Glutamic acid
ME652333
33032
C00025
529100
246
5-aminovaleric acid
5-Aminopentanoic acid
ME652295
138
C00431
536657
174
phenylalanine
Phenylalanine
ME652380
6140
C00079
537804
218
lauric acid
Lauric acid
ME652355
3893
C02679
547906
117
asparagine
Asparagine
ME652305
6267
C00152
553078
188
ribose
Ribose
ME652388
5779
C00121
553135
217
taurine
Taurine
ME652398
1123
C00245
556690
326
xylitol
Xylitol
ME652415
6912
C00379
567437
217
lyxitol
L-Arabitol
ME652359
439255
C00532
573587
217
fucose 1
Fucose
ME652328
439650
C02095
578299
160
UDP-glucuronic acid
UDP-glucuronic acid
ME652407
17473
C00167
587601
217
putrescine
Putrescine
ME652385
1045
C00138
588119
174
glycerol-alpha-phosphate
sn-Glycero-3-phosphate
ME652338
754
C03189
590747
357
glutamine
Glutamine
ME652334
5961
C00064
600315
156
phosphoethanolamine
Phosphoethanolamine
ME652381
1015
C00346
604335
299
azelaic acid
Azelaic acid
ME652307
2266
C08261
610651
317
3-phosphoglycerate
3-Phosphoglyceric acid
ME652294
724
C00597
610734
227
citric acid
Citric acid
ME652315
311
C00158
617342
273
hypoxanthine
Hypoxanthine
ME652349
790
C00262
619128
265
citrulline
Citrulline
ME652316
9750
C00327
621404
157
UDP-N-acetylglucosamine
UDP-N-acetylglucosamine
ME652408
445675
C00043
623789
226
1,5-anhydroglucitol
1,5-Anhydrosorbitol
ME652284
64960
C07326
633969
217
myristic acid
Myristic acid
ME652366
11005
C06424
634414
117
fructose
Fructose
ME652327
5984
C02336
641863
307
mannose
Mannose
ME652363
18950
C00159
645856
205
glucose
Glucose
ME652331
5793
C00221
659798
319
lysine
Lysine
ME652358
5962
C00047
663483
156
histidine
Histidine
ME652346
6274
C00135
663790
154
hexuronic acid
Hexuronic acid
ME652345
152867
-
667373
160
sorbitol
Sorbitol
ME652391
453
C00794
667922
217
tyrosine
Tyrosine
ME652406
6057
C00082
671252
218
pentadecanoic acid
Pentadecylic acid
ME652379
13849
C16537
674647
117
conduritol-beta-epoxide
Conduritol epoxide
ME652317
9989541
-
675635
318
gluconic acid
Gluconic acid
ME652330
10690
C00800
693148
333
xanthine
Xanthine
ME652414
1188
C00385
701688
353
hexitol
Sorbitol
ME652344
453
C00392
704741
217
palmitoleic acid
Palmitoleic acid
ME652376
445638
C08362
706508
117
palmitic acid
Palmitic acid
ME652375
985
C00249
713809
313
myo-inositol
Myo-inositol
ME652365
892
C00137
730022
305
uric acid
Uric acid
ME652411
1175
C00366
730691
441
isoheptadecanoic acid NIST
15-Methylpalmitic acid
ME652351
164860
-
737927
117
guanine
Guanine
ME652341
764
C00242
744307
352
heptadecanoic acid
Margaric acid
ME652343
10465
-
751309
117
octadecanol
Stearyl alcohol
ME652370
8221
D01924
755409
327
linoleic acid
Linoleic acid
ME652357
5280450
C01595
777414
150
oleic acid
Oleic acid
ME652371
445639
C00712
779120
339
tryptophan
Tryptophan
ME652405
6305
C00078
780482
202
stearic acid
Stearic acid
ME652394
5281
C01530
787622
117
spermidine
Spermidine
ME652392
1102
C00315
792924
144
cystine
Cystine
ME652320
595
C01420
804619
218
glucose-6-phosphate
Glucose 6-phosphate
ME652332
5958
C01172
810287
387
pseudo uridine
Pseudouridine
ME652384
15047
C02067
813899
217
nonadecanoic acid
Nonadecylic acid
ME652369
12591
C16535
822782
117
arachidonic acid
Arachidonic acid
ME652304
444899
C00219
834339
91
cis-gondoic acid
cis-Gondoic acid
ME652314
5282768
C16526
847372
367
dehydroabietic acid
Dehydroabietic acid
ME652322
15618
C12078
850374
239
arachidic acid
Arachidic acid
ME652303
10467
C06425
856421
117
uridine
Uridine
ME652412
6029
C00299
861508
217
inosine
Inosine
ME652350
6021
C00294
897184
230
1-monopalmitin
MG 16:0/0:0/0:0
ME652286
3084463
C01885
901749
129
sucrose
Sucrose
ME652396
5988
C00089
915139
271
adenosine
Adenosine
ME652297
60961
C00212
918039
236
behenic acid
Behenic acid
ME652308
8215
C08281
920648
117
maltose 1
Maltose
ME652361
439186
C00208
946601
204
1-monoolein
MG 18:1(9Z)/0:0/0:0
ME652285
5319879
-
952623
129
guanosine
Guanosine
ME652342
6802
C00387
954962
324
1-monostearin
MG 18:0/0:0/0:0
ME652287
24699
D01947
959214
129
cytidine-5-monophosphate NIST
CMP
ME652321
6131
C00055
974825
169
squalene
Squalene
ME652393
5280370
C00751
976237
95
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