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Return to study ST002994 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
xylulose
Xylulose
ME775618
439205
C00312
553450
173
xylose
Xylose
ME775619
135191
C00181
544100
103
xylitol
Xylitol
ME775620
6912
C00379
567437
217
xanthosine
Xanthosine
ME775621
64959
C01762
926133
325
xanthine
Xanthine
ME775622
1188
C00385
701688
353
valine
Valine
ME775623
6287
C00183
313502
144
urocanic acid
Urocanic acid
ME775624
736715
C00785
699866
267
uridine
Uridine
ME775625
6029
C00299
861508
217
uric acid
Uric acid
ME775626
1175
C00366
731038
441
urea
Urea
ME775627
1176
C00086
328888
189
uracil
Uracil
ME775628
1174
C00106
385735
241
undecanoic acid
Undecylic acid
ME775629
8180
C17715
500757
117
UDP GlcNAc
UDP-N-acetylglucosamine
ME775630
445675
C00043
627437
226
tyrosol
Tyrosol
ME775631
10393
C06044
510842
179
tyrosine
Tyrosine
ME775632
6057
C00082
671252
218
tryptophol
Tryptophanol
ME775633
-
.
657957
202
tryptophan
Tryptophan
ME775634
6305
C00078
774603
130
trehalose
Trehalose
ME775635
7427
C01083
948197
191
trans-4-hydroxyproline
trans-4-Hydroxyproline
ME775636
5810
C01157
484934
140
tocopherol alpha-
alpha-Tocopherol
ME775637
638015
C00376
1066526
237
thymine
Thymine
ME775638
1135
C00178
420133
255
thymidine
Thymidine
ME775639
5789
C00214
349402
170
threonine
Threonine
ME775640
6288
C00188
409568
218
threonic acid
Threonic acid
ME775641
5460407
C01620
497572
292
threitol
Threitol
ME775642
169019
C16884
467595
217
taurine
Taurine
ME775643
1123
C00245
556690
326
tagatose
D-Tagatose
ME775644
439312
C00795
631835
307
sucrose
Sucrose
ME775645
5988
C00089
915139
271
succinic acid
Succinic acid
ME775646
1110
C00042
370608
247
succinate semialdehyde
Succinic acid semialdehyde
ME775647
1112
C00232
297024
113
stearic acid
Stearic acid
ME775648
5281
C01530
787622
117
squalene
Squalene
ME775649
638072
C00751
976237
95
spermidine
Spermidine
ME775650
1102
C00315
792924
144
sorbitol
Sorbitol
ME775651
5780
C00794
667922
217
sophorose
Sophorose
ME775652
441432
C08250
962064
307
shikimic acid
Shikimic acid
ME775653
8742
C00493
611100
204
serotonin
Serotonin
ME775654
5202
C00780
863824
174
serine
Serine
ME775655
5951
C00065
395020
204
sarcosine
Sarcosine
ME775656
7311726
C00213
266344
116
saccharic acid
Glucaric acid
ME775657
33037
C00818
699211
333
ribulose-5-phosphate
Ribulose 5-phosphate
ME775658
439184
C00199
735908
357
ribose-5-phosphate
Ribose 5-phosphate
ME775659
439167
C00117
731837
315
ribose
Ribose
ME775660
5779
C00121
553135
217
ribonic acid
Ribonic acid
ME775661
5460677
C01685
597646
292
ribitol
Ribitol
ME775662
827
C00474
575497
217
quinolinic acid
Quinolinic acid
ME775663
1066
C03722
581638
296
pyruvic acid
Pyruvic acid
ME775664
1060
C00022
211668
174
pyrrole-2-carboxylic acid
Pyrrole-2-carboxylic acid
ME775665
12473
C05942
394886
240
pyrophosphate
Pyrophosphate
ME775666
1023
C00013
327517
110
putrescine
Putrescine
ME775667
1045
C00138
588119
174
p-tolyl glucuronide
P-Cresol glucuronide
ME775668
154035
.
847531
180
pseudo uridine
Pseudouridine
ME775669
15047
C02067
813899
217
proline
Proline
ME775670
145742
C00148
364716
142
piperidone
2-Piperidinone
ME775671
12665
.
275603
156
pipecolinic acid
Pipecolic acid
ME775672
6931662
.
404121
156
pimelic acid
Pimelic acid
ME775673
385
C02656
523205
155
phytanic acid
Phytanic acid
ME775674
10380830
.
770604
159
p-hydroxylphenyllactic acid
4-Hydroxyphenyllactic acid
ME775675
9378
C03672
654036
308
phosphoethanolamine
Phosphoethanolamine
ME775676
1015
C00346
604335
299
phosphoenolpyruvate
Phosphoenolpyruvic acid
ME775677
58114173
C00074
518184
211
phosphate
Phosphoric acid
ME775678
1004
C00009
348274
314
phenylethylamine
Phenylethylamine
ME775679
1001
C05332
510327
174
phenylalanine
Phenylalanine
ME775680
6140
C00079
537804
192
phenylacetic acid
Phenylacetic acid
ME775681
999
C07086
368081
164
phenaceturic acid
Phenylacetylglycine
ME775682
68144
C05598
654351
91
pentitol
Arabitol
ME775683
827
D00061
563801
307
pentadecanoic acid
Pentadecylic acid
ME775684
13849
C16537
674647
117
parabanic acid
Parabanic acid
ME775685
67126
C00802
464991
100
pantothenic acid
Pantothenic acid
ME775686
6613
C12276
690887
291
palmitoleic acid
Palmitoleic acid
ME775687
445638
C08362
706508
311
palmitic acid
Palmitic acid
ME775688
985
C00249
713809
313
oxoproline
Oxoproline
ME775689
7405
C01879
485935
156
oxalic acid
Oxalic acid
ME775690
971
C00209
260513
190
orotic acid
Orotic acid
ME775691
967
C00295
586317
254
ornithine
Ornithine
ME775692
6262
C00077
527113
142
O-phosphoserine
DL-O-Phosphoserine
ME775693
57689797
C01005
624355
356
oleic acid
Oleic acid
ME775694
445639
C00712
781527
339
oleamide
Oleamide
ME775695
5283387
C19670
849710
144
octadecylglycerol
MG O-18:0
ME775696
3681
C13858
928878
205
octadecanol
Stearyl alcohol
ME775697
8221
.
755409
327
O-acetylserine
O-Acetylserine
ME775698
99478
C00979
414914
174
norvaline
Norvaline
ME775699
65098
C01826
326715
144
nonadecanoic acid
Nonadecylic acid
ME775700
12591
C16535
822782
117
nicotinic acid
Nicotinic acid
ME775701
938
C00253
366992
180
nicotinamide
Niacinamide
ME775702
936
C00153
471602
179
n-epsilon-trimethyllysine
N-6-Trimethyllysine
ME775703
440121
.
512366
118
N-carbamoylaspartate
N-Carbamoylaspartic acid
ME775704
93072
C00438
611345
257
N-acetylornithine
N-Acetylornithine
ME775705
439232
C00437
682693
174
N-acetylmannosamine
N-Acetyl-mannosamine
ME775706
439281
C00645
735323
319
N-acetylglycine
N-Acetylglycine
ME775707
10972
.
356109
174
N-acetyl-D-galactosamine
N-Acetylgalactosamine
ME775708
440552
C05021
720730
319
N-acetylaspartic acid
N-Acetylaspartic acid
ME775709
65065
C01042
548028
158
myristic acid
Myristic acid
ME775710
11005
C06424
634414
285
myo-inositol
Myo-inositol
ME775711
892
C00137
730022
305
Mevalonic acid
Mevalonic acid
ME775712
-
.
498785
247
methylmaleic acid
Citraconic acid
ME775713
643798
C02226
418804
259
methionine sulfoxide
Methionine sulfoxide
ME775714
158980
C02989
637588
128
methionine
Methionine
ME775715
6137
C00073
483560
176
methanolphosphate
Methanolphosphate
ME775716
13130
.
289520
241
melibiose
Melibiose
ME775717
440658
C05402
988497
361
mannose-6-phosphate
Mannose 6-phosphate
ME775718
65127
C00275
822643
387
mannose
Mannose
ME775719
18950
C00159
645856
205
maltotriose
Maltotriose
ME775720
439586
C01835
1176044
361
maltose
Maltose
ME775721
439186
C00208
946601
204
malonic acid
Malonic acid
ME775722
867
C00383
305372
233
malic acid
Malic acid
ME775723
525
C00711
463180
233
maleimide
Maleimide
ME775724
10935
C07272
245118
154
lyxose
Lyxose
ME775725
439240
C00476
541086
217
lyxitol
L-Arabitol
ME775726
439255
C00532
573587
217
lysine
Lysine
ME775727
5962
C00047
663483
317
lithocholic acid
Lithocholic acid
ME775728
9903
C03990
1104161
215
linoleic acid
Linoleic acid
ME775729
5280450
C01595
777414
150
lignoceric acid
Lignoceric acid
ME775730
11197
C08320
978597
132
leucine
Leucine
ME775731
6106
C00123
345845
158
lauric acid
Lauric acid
ME775732
3893
C02679
547906
117
lanosterol
Lanosterol
ME775733
246983
C01724
1129573
393
lactose
Lactose
ME775734
6134
C01970
936998
204
lactobionic acid
Lactobionic acid
ME775735
7314
C04247
972139
204
lactitol
Lactitol
ME775736
157355
C13542
959541
361
lactic acid
Lactic acid
ME775737
612
C01432
217657
191
lactamide
Lactamide
ME775738
94220
.
265698
232
kynurenine
Kynurenine
ME775739
25245862
C01718
769709
218
itaconic acid
Itaconic acid
ME775740
811
C00490
386511
147
isothreonic acid
D-Threonic acid
ME775741
151152
C00639
489385
292
isoribose
D-Ribopyranose
ME775742
10975657
.
558730
217
isopentadecanoic acid
Isopentadecylic acid
ME775743
151014
.
663518
117
isolinoleic acid
-
ME775744
5312483
.
794629
156
isoleucine
Isoleucine
ME775745
6306
C00407
359251
158
isoheptadecanoic acid
15-Methylpalmitic acid
ME775746
164860
.
737927
117
isocitric acid
Isocitric acid
ME775747
5318532
C00451
617338
245
inositol-4-monophosphate
Inositol 4-phosphate
ME775748
440043
C03546
845976
315
inosine
Inosine
ME775749
6021
C00294
897434
230
indoxyl sulfate
Indoxyl sulfate
ME775750
10258
.
577333
277
indole-3-propionic acid
3-Indolepropionic acid
ME775751
3744
.
732249
202
indole-3-lactate
Indolelactic acid
ME775752
-
.
764079
202
indole-3-acetate
Indoleacetic acid
ME775753
802
C00954
684929
202
ile-ile
Ile-Ile
ME775754
-
.
677904
158
hypoxanthine
Hypoxanthine
ME775755
790
C00262
619128
265
hydroxycarbamate
Hydroxycarbamic acid
ME775756
16639161
.
325318
278
hydrocinnamic acid
Hydrocinnamic acid
ME775757
107
C05629
434422
104
homoserine
Homoserine
ME775758
12647
C00263
443878
218
histidine
Histidine
ME775759
6274
C00135
663102
154
hippuric acid
Hippuric acid
ME775760
464
C01586
637236
206
heptadecanoic acid
Margaric acid
ME775761
10465
.
751309
117
guanosine
Guanosine
ME775762
6802
C00387
957445
324
guanine
Guanine
ME775763
764
C00242
744307
352
glycyl-proline
Gly-Pro
ME775764
3013625
.
691662
174
glycyl tyrosine
Gly-Tyr
ME775765
92829
.
922071
174
glycolic acid
Glycolic acid
ME775766
757
C00160
227636
177
glycocyamine
Guanidoacetic acid
ME775767
763
C00581
511016
171
glycine
Glycine
ME775768
750
C00037
368707
248
glycerol-alpha-phosphate
sn-Glycero-3-phosphate
ME775769
754
C03189
590747
357
glycerol-3-galactoside
Galactosylglycerol
ME775770
16048618
C05401
800205
204
glycerol
Glycerol
ME775771
753
C00116
344466
205
glyceric acid
Glyceric acid
ME775772
439194
C00258
377495
189
glutaric acid
Glutaric acid
ME775773
743
C00489
421596
261
glutamine
Glutamine
ME775774
5961
C00064
600315
156
glutamic acid
Glutamic acid
ME775775
33032
C00025
529100
246
glucose-6-phosphate
Glucose 6-phosphate
ME775776
5958
C00092
818275
387
glucose-1-phosphate
Glucose 1-phosphate
ME775777
65533
C00103
594647
217
glucose
Glucose
ME775778
64689
C00221
659798
319
gluconic acid
Gluconic acid
ME775779
6857417
C00800
693148
333
galactose-6-phosphate
Galactose 6-phosphate
ME775780
439404
C01113
828102
387
galactinol
Galactinol
ME775781
11727586
C01235
1017580
204
fumaric acid
Fumaric acid
ME775782
444972
C00122
390775
245
fucose
Fucose
ME775783
439650
C02095
578299
160
fructose-6-phosphate
Fructose 6-phosphate
ME775784
440641
C05345
804750
315
fructose-1-phosphate
Fructose 1-phosphate
ME775785
439394
C01094
803180
387
fructose
Fructose
ME775786
439709
C02336
639442
307
ethanolamine
Ethanolamine
ME775787
700
C00189
344719
174
ethanol phosphate
Ethylphosphate
ME775788
74190
.
317291
211
erythrose
Erythrose
ME775789
439574
C01796
443306
205
erythritol
Erythritol
ME775790
222285
C00503
471922
217
epsilon-caprolactam
Epsilon-caprolactam
ME775791
7768
C06593
353069
170
elaidic acid
Elaidic acid
ME775792
637517
C01712
784781
129
docosahexaenoic acid
Docosahexaenoic acid
ME775793
445580
C06429
902819
91
dihydroxyacetone
Dihydroxyacetone
ME775794
670
C00184
332120
89
D-erythro-sphingosine
Sphingosine
ME775795
5280335
C00319
859500
204
deoxycholic acid
Deoxycholic acid
ME775796
222528
C04483
1106875
255
dehydroabietic acid
Dehydroabietic acid
ME775797
94391
C12078
849349
239
cytosin
Cytosine
ME775798
597
C00380
486724
254
cytidine
Cytidine
ME775799
-
.
934269
223
cystine
Cystine
ME775800
595
C01420
804619
218
cysteine-glycine
Cys-Gly
ME775801
439498
C01419
715335
220
cysteine
Cysteine
ME775802
5862
C00097
500158
220
creatinine
Creatinine
ME775803
588
C00791
502599
115
conduritol-beta-epoxide
Conduritol epoxide
ME775804
9989541
.
675635
318
citrulline
Citrulline
ME775805
9750
C00327
621404
157
citric acid
Citric acid
ME775806
311
C00158
617342
273
citramalic acid
Citramalic acid
ME775807
1081
C00815
456203
247
cis-gondoic acid
cis-Gondoic acid
ME775808
5282768
C16526
847372
367
ciliatine
Ciliatine
ME775809
339
C03557
588335
398
cholic acid
Cholic acid
ME775810
221493
C05463
1109517
253
cholesterone
Cholestenone
ME775811
91477
C00599
1095940
456
cholesterol
Cholesterol
ME775812
5997
C00187
1078536
129
cerotinic acid
Cerotic acid
ME775813
10469
.
1033286
145
cellobiose
Cellobiose
ME775814
6255
C01971
932179
204
catechol
Pyrocatechol
ME775815
289
C00090
376695
254
butyrolactam
2-Pyrrolidinone
ME775816
12025
.
277199
142
beta-sitosterol
Sitosterol
ME775817
222284
C01753
1128225
129
beta-glycerolphosphate
sn-Glycero-2-phosphate
ME775818
2526
C02979
574470
243
beta-glutamic acid
Isoglutamic acid
ME775819
73064
C05574
525547
232
beta-gentiobiose
beta-Gentiobiose
ME775820
441422
C08240
974676
204
beta-alanine
beta-Alanine
ME775821
239
C00099
435564
248
benzoic acid
Benzoic acid
ME775822
243
C00180
339067
179
behenic acid
Behenic acid
ME775823
8215
C08281
920648
117
aspartic acid
Aspartic acid
ME775824
5960
C00049
480387
232
asparagine
Asparagine
ME775825
6267
C00152
553743
231
arachidonic acid
Arachidonic acid
ME775826
444899
C00219
834339
91
arachidic acid
Arachidic acid
ME775827
10467
C06425
856421
117
aminomalonate
Aminomalonic acid
ME775828
100714
C00872
455754
218
alpha-ketoglutarate
2-Oxoglutaric acid
ME775829
51
C00026
507392
198
alpha-aminoadipic acid
alpha-Aminoadipic acid
ME775830
92136
C00956
573295
260
allantoic acid
Allantoic acid
ME775831
203
C00499
726050
259
alanine-alanine
Ala-Ala
ME775832
5484352
C00993
522546
116
alanine
Alanine
ME775833
5950
C00041
243971
116
adipic acid
Adipic acid
ME775834
196
C06104
474435
111
adenosine-5-monophosphate
AMP
ME775835
6083
C00020
1038688
169
adenosine
Adenosine
ME775836
60961
C00212
918039
236
adenine
Adenine
ME775837
190
C00147
646701
264
aconitic acid
cis-Aconitic acid
ME775838
643757
C00417
586815
229
9-myristoleate
Myristoleic acid
ME775839
-
.
630100
117
5-methoxytryptamine
5-Methoxytryptamine
ME775840
1833
C05659
857675
174
5-hydroxynorvaline
-
ME775841
95562
.
494077
142
5-aminovaleric acid
5-Aminopentanoic acid
ME775842
138
C00431
555805
174
5,6-dihydrouracil
Dihydrouracil
ME775843
-
.
470116
243
4-hydroxyphenylacetic acid
4-Hydroxyphenylacetic acid
ME775844
127
C00642
542795
179
4-hydroxycinnamic acid
cis-p-Coumaric acid
ME775845
637542
C00811
674616
219
4-hydroxybutyric acid
4-Hydroxybutyric acid
ME775846
10413
C00989
325027
233
4-aminobutyric acid
4-Aminopentanoic acid
ME775847
119
C00334
488730
304
3-ureidopropionate
Ureidopropionic acid
ME775848
111
C02642
554966
161
3-phosphoglycerate
3-Phosphoglyceric acid
ME775849
724
C00597
610734
227
3-phenyllactic acid
Phenyllactic acid
ME775850
3848
.
516011
193
3-hydroxypropionic acid
Hydroxypropionic acid
ME775851
68152
C01013
269265
177
3-hydroxypalmitic acid
3R-Hydroxypalmitic acid
ME775852
15569776
.
774930
233
3-hydroxybutyric acid
3-Hydroxybutyric acid
ME775853
92135
C01089
278829
191
3-hydroxy-3-methylglutaric acid
3-Hydroxymethylglutaric acid
ME775854
1662
C03761
521554
247
3-aminoisobutyric acid
3-Aminoisobutanoic acid
ME775855
64956
C05145
452655
248
3-(4-hydroxyphenyl)propionic acid
Desaminotyrosine
ME775856
10394
C01744
598147
179
2-picolinic acid
Picolinic acid
ME775857
1018
C10164
381532
180
2-monopalmitin
MG 0:0/16:0/0:0
ME775858
123409
.
890356
129
2-monoolein
MG 0:0/18:1(9Z)/0:0
ME775859
5319879
.
941794
129
2-methylglyceric acid
2,3-Dihydroxyisobutyric acid
ME775860
560781
.
377962
219
2-ketoisovaleric acid
Ketoisovaleric acid
ME775861
49
C00141
263177
89
2-ketoisocaproic acid
Ketoleucine
ME775862
70
C00233
310761
89
2-ketoglucose dimethylacetal
D-Glucosone
ME775863
159630
.
456913
234
2-ketobutyric acid
3-Methyl pyruvic acid
ME775864
58
C00109
243116
89
2-ketoadipic acid
Oxoadipic acid
ME775865
71
C00322
324048
89
2-hydroxyvaleric acid
2-Hydroxyvaleric acid
ME775866
98009
.
309587
131
2-hydroxyhexanoic acid
2-Hydroxyhexanoic acid
ME775867
99824
.
323093
159
2-hydroxyglutaric acid
2-Hydroxyglutaric acid
ME775868
43
C02630
506306
247
2-hydroxybutanoic acid
2-Hydroxybutyric acid
ME775869
440864
C05984
258161
131
2-hydroxy-2-methylbutanoic acid
2-Hydroxy-2-methyl-butyric acid
ME775870
95433
.
264833
145
2-deoxytetronic acid
3,4-Dihydroxybutyric acid
ME775871
150929
.
433456
189
2-deoxypentitol
2-Deoxy-D-ribitol
ME775872
249377
.
521785
231
2'-deoxyguanosine
Deoxyguanosine
ME775873
187790
C00330
959764
280
2-aminobutyric acid
2-Aminobutyric acid
ME775874
6657
C02721
285825
130
2,8-dihydroxyquinoline
Quinoline-2,8-diol
ME775875
97250
C06342
626989
290
2,6-diaminopimelic acid
2,6-Diaminopimelic acid
ME775876
865
.
686035
200
2,5-dihydroxypyrazine
2,5-Dihydroxypyrazine
ME775877
23368901
.
397526
241
1-monostearin
MG 18:0/0:0/0:0
ME775878
24699
D01947
959214
203
1-monopalmitin
MG 16:0/0:0/0:0
ME775879
14900
C01885
901749
371
1-monoolein
MG 18:1(9Z)/0:0/0:0
ME775880
5283468
.
952623
129
1-hexadecanol
Cetyl alcohol
ME775881
2682
C00823
679596
299
1,5-anhydroglucitol
1,5-Anhydrosorbitol
ME775882
64960
C07326
632918
217
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