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Return to study ST000981 main page
Analysis: GC POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
palatinitol
1,2,3-Butanetriol
ME241523
-
-
996670
204
1,2-anhydro-myo-inositol NIST
1,2-Anhydro-myo-inositol
ME241708
119054
-
651472
318
1,5-anhydroglucitol
1,5-Anhydrosorbitol
ME241707
64960
C07326
633969
217
1-kestose
1-Kestose
ME241705
440080
C03661
1123027
361
1-methyladenosine
1-Methyladenosine
ME241704
-
-
829921
259
butane-2,3-diol NIST
2,3-Butanediol
ME241640
262
C03046
205778
117
2,3-dihydroxybutanoic acid NIST
2,3-Dihydroxybutanoic acid
ME241700
250402
-
384796
292
2-methylglyceric acid NIST
2,3-Dihydroxyisobutyric acid
ME241688
560781
-
372491
219
2,4-diaminobutyric acid
2,4-Diaminobutyric acid
ME241699
134490
C03283
570766
174
2,5-dihydroxypyrazine NIST
2,5-Dihydroxypyrazine
ME241698
23368901
-
397526
241
2-deoxyerythritol
2-Deoxyerythritol
ME241696
18302
-
354388
117
2-hydroxybutanoic acid
2-Hydroxybutyric acid
ME241693
440864
C05984
258161
131
2-hydroxyglutaric acid
2-Hydroxyglutaric acid
ME241692
43
C02630
506306
247
2-hydroxyhexanoic acid
2-Hydroxyhexanoic acid
ME241691
-
-
323093
159
2-hydroxyvaleric acid
2-Hydroxyvaleric acid
ME241690
98009
-
309587
131
alpha-ketoglutarate
2-Oxoglutaric acid
ME241654
51
C00026
507392
198
piperidone
2-Piperidinone
ME241506
12665
-
275603
156
butyrolactam NIST
2-Pyrrolidinone
ME241639
12025
-
277199
142
3-(3-hydroxyphenyl)propionic acid
3-(3-Hydroxyphenyl)propanoic acid
ME241685
91
C11457
583925
192
3,4-dihydroxyphenylacetic acid
3,4-Dihydroxybenzeneacetic acid
ME241680
547
C01161
625046
179
2-deoxytetronic acid
3,4-Dihydroxybutyric acid
ME241694
150929
-
433456
189
3,4-dihydroxyhydrocinnamic acid NIST
3,4-Dihydroxyhydrocinnamic acid
ME241681
348154
C10447
673176
179
3,6-anhydro-D-galactose
3,6-Anhydro-galactose
ME241679
16069996
C06474
588886
231
3-aminoisobutyric acid
3-Aminoisobutanoic acid
ME241678
64956
C05145
452655
248
3-hydroxybutyric acid
3-Hydroxybutyric acid
ME241676
92135
C01089
278632
191
3-hydroxy-3-methylglutaric acid
3-Hydroxymethylglutaric acid
ME241677
1662
C03761
521554
247
3-hydroxyphenylacetic acid
3-Hydroxyphenylacetic acid
ME241674
12122
C05593
527648
164
3-hydroxypalmitic acid
3R-Hydroxypalmitic acid
ME241675
15569776
-
774930
233
4-aminobutyric acid
4-Aminopentanoic acid
ME241671
119
C00334
488730
304
4-hydroxybenzoate
4-Hydroxybenzoic acid
ME241670
135
C00156
537925
223
4-hydroxybutyric acid
4-Hydroxybutyric acid
ME241669
10413
C00989
325027
233
4-hydroxyhippuric acid NIST
4-Hydroxyhippuric acid
ME241668
151012
-
784581
294
4-hydroxyphenylacetic acid
4-Hydroxyphenylacetic acid
ME241667
127
C00642
542795
179
p-hydroxylphenyllactic acid
4-Hydroxyphenyllactic acid
ME241510
9378
C03672
654036
308
4-methyl-5-thiazoleethanol
5-(2-Hydroxyethyl)-4-methylthiazole
ME241666
-
-
408609
103
5-aminovaleric acid
5-Aminopentanoic acid
ME241664
138
C00431
540425
174
6-hydroxynicotinic acid
6-Hydroxynicotinic acid
ME241662
-
-
510614
268
acetophenone NIST
Acetophenone
ME241661
7410
C07113
238615
105
adenine
Adenine
ME241660
-
-
646701
264
adenosine
Adenosine
ME241659
60961
C00212
918039
236
adipic acid
Adipic acid
ME241658
196
C06104
474435
111
alanine-alanine
Ala-Ala
ME241656
5484352
C00993
522546
116
alanine
Alanine
ME241657
5950
C00041
243971
116
allantoic acid
Allantoic acid
ME241655
-
-
726050
259
tocopherol alpha-
alpha-Tocopherol
ME241475
638015
C00376
1067809
237
aminomalonate
Aminomalonic acid
ME241653
100714
C00872
455754
218
pentitol
Arabitol
ME241516
827
D00061
563801
307
arachidic acid
Arachidic acid
ME241652
10467
C06425
856421
117
arachidonic acid
Arachidonic acid
ME241651
444899
C00219
834339
91
asparagine
Asparagine
ME241650
6267
C00152
553078
188
asparagine dehydrated
Asparagine
ME241649
-
-
477011
100
behenic acid
Behenic acid
ME241648
8215
C08281
920648
117
benzoic acid
Benzoic acid
ME241647
243
C00180
339067
179
beta-alanine
beta-Alanine
ME241646
239
C00099
435564
248
beta-gentiobiose
beta-Gentiobiose
ME241645
441422
C08240
965352
160
tocopherol beta-
beta-tocopherol
ME241476
8989
C14152
1022815
223
biphenyl
Biphenyl
ME241641
-
-
426625
154
3,4-dihydroxycinnamic acid
Caffeic acid
ME241682
689043
C01197
748847
219
capric acid
Capric acid
ME241638
2969
C01571
452386
229
caprylic acid
Caprylic acid
ME241637
379
C06423
343457
201
cellobiose
Cellobiose
ME241636
6255
C01971
932179
204
cerotinic acid
Cerotic acid
ME241635
10469
-
1033286
145
1-hexadecanol
Cetyl alcohol
ME241706
2682
C00823
679596
299
chenodeoxycholic acid
Chenodeoxycholic acid
ME241634
10133
C02528
1114867
255
cholesterol
Cholesterol
ME241633
5997
C00187
1078536
129
cholic acid
Cholic acid
ME241632
221493
C05463
1109517
253
cis-gondoic acid
cis-Gondoic acid
ME241631
5282768
C16526
847372
367
cis-sinapinic acid
cis-Sinapic acid
ME241630
1549091
C00482
718113
338
citric acid
Citric acid
ME241629
311
C00158
617342
273
citrulline
Citrulline
ME241628
9750
C00327
621404
157
conduritol-beta-epoxide
Conduritol epoxide
ME241627
9989541
-
675635
318
creatinine
Creatinine
ME241626
588
C00791
502599
115
cysteine
Cysteine
ME241625
5862
C00097
500158
220
cystine
Cystine
ME241624
595
C01420
804619
218
cytosin
Cytosine
ME241623
597
C00380
486724
254
daidzein
Daidzein
ME241622
-
-
1013259
398
tocopherol delta-
delta-Tocopherol
ME241478
92094
C14151
997765
208
deoxycholic acid
Deoxycholic acid
ME241621
222528
C04483
1106875
255
2'-deoxyguanosine
Deoxyguanosine
ME241695
-
-
959764
280
3-(4-hydroxyphenyl)propionic acid
Desaminotyrosine
ME241684
-
-
598147
179
diglycerol
Diglycerol
ME241619
42953
-
591074
103
dihydrocholesterol
Dihydrocholesterol
ME241618
66066
C12978
1082070
215
docosahexaenoic acid
Docosahexaenoic acid
ME241617
-
-
902819
91
tagatose
D-Tagatose
ME241486
-
-
629499
307
isothreonic acid
D-Threonic acid
ME241573
151152
C00639
489385
292
erythritol
Erythritol
ME241616
222285
C00503
471922
217
erythrose
Erythrose
ME241615
439574
C01796
443306
205
ethanolamine
Ethanolamine
ME241614
700
C00189
344719
174
fructose
Fructose
ME241612
439709
C02336
639442
307
fucose
Fucose
ME241611
439650
C02095
578299
160
fumaric acid
Fumaric acid
ME241610
444972
C00122
390016
245
galactinol
Galactinol
ME241609
11727586
C01235
1017580
204
galactonic acid
Galactonic acid
ME241608
128869
C00880
690882
292
galactose
Galactose
ME241607
439357
C00984
647344
319
glycerol-3-galactoside
Galactosylglycerol
ME241596
16048618
C05401
800205
204
galacturonic acid
Galacturonic acid
ME241606
441476
C08348
669400
333
tocopherol gamma-
gamma-Tocopherol
ME241477
92729
C02483
1026121
223
glucoheptulose
Glucoheptulose
ME241605
5459879
C02076
828606
217
gluconic acid
Gluconic acid
ME241604
6857417
C00800
693148
333
levoglucosan
Glucosan
ME241566
2724705
-
569637
204
glucose
Glucose
ME241603
64689
C00221
659798
319
glucose-1-phosphate
Glucose 1-phosphate
ME241602
65533
C00103
594647
217
glutamic acid
Glutamic acid
ME241601
33032
C00025
529100
246
glutamine
Glutamine
ME241600
5961
C00064
600000
156
glutaric acid
Glutaric acid
ME241599
743
C00489
421596
261
glyceric acid
Glyceric acid
ME241598
439194
C00258
377495
189
glycerol
Glycerol
ME241597
753
C00116
344466
205
glycine
Glycine
ME241594
750
C00037
368707
248
glycolic acid
Glycolic acid
ME241593
757
C00160
227636
177
glycyl-proline
Gly-Pro
ME241592
3013625
-
691662
174
guanine
Guanine
ME241591
764
C00242
744307
352
guanosine
Guanosine
ME241590
6802
C00387
954962
324
histidine
Histidine
ME241586
6274
C00135
663790
154
homoserine
Homoserine
ME241585
12647
C00263
443878
218
homovanillic acid
Homovanillic acid
ME241584
1738
C05582
601084
326
hydrocinnamic acid
Hydrocinnamic acid
ME241583
-
-
434422
104
hydroxylamine
Hydroxylamine
ME241582
787
C00192
255241
146
3-hydroxypropionic acid
Hydroxypropionic acid
ME241673
68152
C01013
269265
177
hypoxanthine
Hypoxanthine
ME241581
790
C00262
619128
265
indole-3-acetate
Indoleacetic acid
ME241580
802
C00954
684929
202
indole-3-lactate
Indolelactic acid
ME241579
92904
C02043
764586
202
inosine
Inosine
ME241578
6021
C00294
897434
230
inositol-4-monophosphate
Inositol 4-phosphate
ME241577
440043
C03546
845976
315
beta-glutamic acid
Isoglutamic acid
ME241644
73064
C05574
525547
232
isoleucine
Isoleucine
ME241576
6306
C00407
359251
158
isomaltose
Isomaltose
ME241575
439193
C00252
983199
160
isopentadecanoic acid
Isopentadecylic acid
ME241574
-
-
663518
117
ketohexose
Ketohexose
ME241572
439312
C00795
627414
307
2-ketoisocaproic acid
Ketoleucine
ME241689
70
C00233
310761
89
lactamide
Lactamide
ME241571
94220
-
265698
232
lactic acid
Lactic acid
ME241570
612
C01432
217657
191
lactose
Lactose
ME241569
440995
C00243
935640
191
lanosterol
Lanosterol
ME241568
-
-
1129573
393
lyxitol
L-Arabitol
ME241561
439255
C00532
573587
217
leucine
Leucine
ME241567
6106
C00123
346101
158
lignoceric acid
Lignoceric acid
ME241565
11197
C08320
978597
132
linoleic acid
Linoleic acid
ME241564
5280450
C01595
777414
150
lysine
Lysine
ME241562
5962
C00047
663483
156
lyxose
Lyxose
ME241560
439240
C00476
541086
217
maleimide
Maleimide
ME241559
10935
C07272
245118
154
malic acid
Malic acid
ME241558
525
C00711
463180
233
malonic acid
Malonic acid
ME241557
867
C00383
305372
233
maltitol
Maltitol
ME241556
493591
D04845
976828
361
maltose
Maltose
ME241555
439186
C00208
946601
204
maltotriose
Maltotriose
ME241553
439586
C01835
1176044
361
mannose
Mannose
ME241552
18950
C00159
645856
205
heptadecanoic acid
Margaric acid
ME241589
10465
-
751309
117
melezitose
Melezitose
ME241551
92817
C08243
1146704
361
melibiose
Melibiose
ME241550
440658
C05402
988497
361
methanolphosphate
Methanolphosphate
ME241549
13130
-
289520
241
methionine
Methionine
ME241548
6137
C00073
483560
176
methionine sulfoxide
Methionine sulfoxide
ME241547
158980
C02989
637588
128
2-monopalmitin
MG 0:0/16:0/0:0
ME241686
123409
-
890356
129
2-monoolein
MG 0:0/18:1(9Z)/0:0
ME241687
5319879
-
941794
129
monomyristin
MG 14:0
ME241546
79050
-
838305
343
1-monopalmitin
MG 16:0/0:0/0:0
ME241702
14900
C01885
901749
129
1-monostearin
MG 18:0/0:0/0:0
ME241701
24699
D01947
959214
203
1-monoolein
MG 18:1(9Z)/0:0/0:0
ME241703
5283468
-
952623
129
hexadecylglycerol NIST
MG O-16:0
ME241588
-
-
867593
205
octadecylglycerol
MG O-18:0
ME241529
-
-
928878
205
myo-inositol
Myo-inositol
ME241545
892
C00137
730022
305
myristic acid
Myristic acid
ME241544
11005
C06424
634414
285
N-acetylaspartic acid
N-Acetylaspartic acid
ME241543
65065
C01042
548028
158
N-acetyl-D-galactosamine
N-Acetylgalactosamine
ME241542
-
-
723255
202
N-acetylglutamate
N-Acetylglutamic acid
ME241539
70914
C00624
604748
216
n-acetyl-d-hexosamine
N-Acetylhexosamine
ME241541
24139
C03878
746341
319
N-acetyl-D-mannosamine
N-Acetyl-mannosamine
ME241540
-
-
731858
319
N-acetylornithine
N-Acetylornithine
ME241538
439232
C00437
694651
174
N-acetylputrescine
N-Acetylputrescine
ME241537
122356
C02714
595523
174
nicotinic acid
Nicotinic acid
ME241536
938
C00253
366992
180
N-methylalanine
N-Methylalanine
ME241535
5288725
C02721
286855
130
nonadecanoic acid
Nonadecylic acid
ME241534
12591
C16535
822782
117
norleucine
Norleucine
ME241533
21236
C01933
374120
158
norvaline
Norvaline
ME241532
65098
C01826
326715
144
O-acetylserine
O-Acetylserine
ME241531
99478
C00979
414914
174
linolenic acid
Octadecatrienoic acid
ME241563
5280934
C06427
780376
108
oleamide NIST
Oleamide
ME241528
5283387
C19670
849710
144
oleic acid
Oleic acid
ME241527
445639
C00712
781527
339
ornithine
Ornithine
ME241526
6262
C00077
527113
142
orotic acid
Orotic acid
ME241525
967
C00295
586317
254
oxoproline
Oxoproline
ME241524
7405
C01879
485935
156
palmitic acid
Palmitic acid
ME241522
985
C00249
713809
313
palmitoleic acid
Palmitoleic acid
ME241521
445638
C08362
706508
311
pantothenic acid
Pantothenic acid
ME241520
6613
C12276
690887
291
parabanic acid NIST
Parabanic acid
ME241519
67126
C00802
464991
100
pelargonic acid
Pelargonic acid
ME241518
8158
C01601
399229
117
pentadecanoic acid
Pentadecylic acid
ME241517
13849
C16537
674647
117
phenylacetic acid
Phenylacetic acid
ME241515
999
C07086
368081
164
phenylalanine
Phenylalanine
ME241514
6140
C00079
537804
218
phenylethylamine
Phenylethylamine
ME241513
1001
C05332
513300
174
3-phenyllactic acid
Phenyllactic acid
ME241672
-
-
516011
193
phosphoethanolamine
Phosphoethanolamine
ME241511
1015
C00346
603912
299
phosphate
Phosphoric acid
ME241512
1004
C00009
345365
314
phytosphingosine
Phytosphingosine
ME241509
122121
C12144
910976
204
pinitol
Pinitol
ME241508
164619
C03844
622466
260
pipecolinic acid
Pipecolic acid
ME241507
6931662
-
404121
156
proline
Proline
ME241505
145742
C00148
364716
142
propane-1,3-diol NIST
Propane-1,3-diol
ME241504
10442
C02457
214380
177
3,4-dihydroxybenzoic acid
Protocatechuic acid
ME241683
72
C00230
620200
193
pseudo uridine
Pseudouridine
ME241503
15047
C02067
813899
217
putrescine
Putrescine
ME241502
1045
C00138
588119
174
pyruvic acid
Pyruvic acid
ME241501
1060
C00022
213805
174
2,8-dihydroxyquinoline
Quinoline-2,8-diol
ME241697
97250
C06342
626989
290
6-deoxyglucose
Quinovose
ME241663
441480
C08352
573663
117
raffinose
Raffinose
ME241500
439242
C00492
1120886
361
ribitol
Ribitol
ME241499
827
C00474
575497
217
ribonic acid
Ribonic acid
ME241498
5460677
C01685
599680
292
ribose
Ribose
ME241497
5779
C00121
553135
217
sarcosine
Sarcosine
ME241496
-
-
266344
116
serine
Serine
ME241495
5951
C00065
395020
218
shikimic acid
Shikimic acid
ME241494
8742
C00493
611100
204
sinapinic acid
Sinapic acid
ME241493
80642
C20448
788416
338
beta-sitosterol
Sitosterol
ME241642
222284
C01753
1128225
129
glycerol-alpha-phosphate
sn-Glycero-3-phosphate
ME241595
754
C03189
590747
357
sophorose
Sophorose
ME241492
441432
C08250
965726
307
hexitol
Sorbitol
ME241587
453
C00392
704741
217
sorbitol
Sorbitol
ME241491
5780
C00794
667922
217
D-erythro-sphingosine
Sphingosine
ME241620
-
-
859500
204
squalene
Squalene
ME241490
638072
C00751
976237
95
stearic acid
Stearic acid
ME241489
5281
C01530
787622
117
octadecanol
Stearyl alcohol
ME241530
8221
-
755409
327
succinic acid
Succinic acid
ME241488
1110
C00042
370608
247
sucrose
Sucrose
ME241487
5988
C00089
918352
361
taurine
Taurine
ME241485
1123
C00245
556690
326
threitol
Threitol
ME241484
169019
C16884
467595
217
threonic acid
Threonic acid
ME241483
5460407
C01620
497572
292
threonine
Threonine
ME241482
6288
C00188
408777
218
thymidine
Thymidine
ME241481
5789
C00214
349402
170
thymine
Thymine
ME241480
1135
C00178
420133
255
tocopherol acetate
Tocopherol acetate
ME241479
86472
C13202
1081080
164
trans-4-hydroxyproline
trans-4-Hydroxyproline
ME241474
5810
C01157
484934
140
ferulic acid
trans-Ferulic acid
ME241613
445858
C01494
732779
338
tryptophan
Tryptophan
ME241473
6305
C00078
780482
202
tyramine
Tyramine
ME241472
5610
C00483
664737
174
tyrosine
Tyrosine
ME241471
6057
C00082
671252
218
tyrosol
Tyrosol
ME241470
10393
C06044
510842
179
UDP-glucuronic acid
UDP-glucuronic acid
ME241469
17473
C00167
585473
217
uracil
Uracil
ME241468
1174
C00106
385735
241
urea
Urea
ME241467
1176
C00086
326574
189
uric acid
Uric acid
ME241466
1175
C00366
730691
441
uridine
Uridine
ME241465
6029
C00299
861508
217
urocanic acid
Urocanic acid
ME241464
-
-
699866
267
valine
Valine
ME241463
6287
C00183
313502
144
vanillic acid
Vanillic acid
ME241462
8468
C06672
597845
297
xanthine
Xanthine
ME241461
1188
C00385
701688
353
xylitol
Xylitol
ME241460
6912
C00379
567437
217
xylonic acid isomer
Xylonic acid
ME241459
10264
C02341
590775
189
xylose
Xylose
ME241458
135191
C00181
543267
103
xylulose NIST
Xylulose
ME241457
439205
C00312
553450
173
5,6-dihydrouracil major
-
ME241665
-
-
470116
243
beta-mannosylglycerate
-
ME241643
-
-
775654
204
maltotriitol
-
ME241554
-
-
1216941
361
UCSD Metabolomics Workbench, a resource sponsored by the Common Fund of the National Institutes of Health
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