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Return to study ST002026 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
phosphate
Phosphoric acid
ME470215
1004
C00009
-
314
adenosine-5-monophosphate
AMP
ME470087
6083
C00020
-
169
pyruvic acid
Pyruvic acid
ME470223
1060
C00022
-
174
glutamic acid
Glutamic acid
ME470144
33032
C00025
-
246
alpha-ketoglutarate
2-Oxoglutaric acid
ME470092
51
C00026
-
198
lysine
Lysine
ME470179
5962
C00047
-
317
aspartic acid
Aspartic acid
ME470099
44367445
C00049
-
232
glutamine
Glutamine
ME470145
5961
C00064
-
156
enolpyruvate
Phosphoenolpyruvic acid
ME470128
1005
C00074
-
217
ornithine
Ornithine
ME470206
6262
C00077
-
142
tyrosine
Tyrosine
ME470247
6057
C00082
-
218
urea
Urea
ME470251
1176
C00086
-
189
sucrose
Sucrose
ME470236
5988
C00089
-
271
glucose-6-phosphate
Glucose 6-phosphate
ME470143
5958
C00092
-
387
cysteine
Cysteine
ME470118
5862
C00097
-
220
beta-alanine
beta-Alanine
ME470102
239
C00099
-
248
uracil
Uracil
ME470250
1174
C00106
-
241
glycerol
Glycerol
ME470148
753
C00116
-
205
ribose
Ribose
ME470226
5779
C00121
-
217
fumaric acid
Fumaric acid
ME470136
21883788
C00122
-
245
leucine
Leucine
ME470175
6106
C00123
-
158
phenol
Phenol
ME470212
20488062
C00146
-
151
adenine
Adenine
ME470086
190
C00147
-
264
asparagine
Asparagine
ME470098
6267
C00152
-
231
4-hydroxybenzoic acid
4-Hydroxybenzoic acid
ME470076
135
C00156
-
267
citric acid
Citric acid
ME470117
19782904
C00158
-
273
glycolic acid
Glycolic acid
ME470150
3698251
C00160
-
177
UDP-glucuronic acid
UDP-glucuronic acid
ME470249
17473
C00167
-
217
thymine
Thymine
ME470243
1135
C00178
-
255
benzoic acid
Benzoic acid
ME470101
20144841
C00180
-
179
xylose
Xylose
ME470257
135191
C00181
-
103
cholesterol
Cholesterol
ME470114
5997
C00187
-
129
threonine
Threonine
ME470241
6288
C00188
-
218
hydroxylamine
Hydroxylamine
ME470160
787
C00192
-
146
maltose
Maltose
ME470184
439186
C00208
-
204
thymidine
Thymidine
ME470242
5789
C00214
-
170
arachidonic acid
Arachidonic acid
ME470097
444899
C00219
-
91
glucose
Glucose
ME470142
64689
C00221
-
319
3,4-dihydroxybenzoic acid
Protocatechuic acid
ME470069
72
C00230
-
193
succinate semialdehyde
Succinic acid semialdehyde
ME470235
1112
C00232
-
113
2-ketoisocaproic acid
Ketoleucine
ME470055
70
C00233
-
89
guanine
Guanine
ME470153
764
C00242
-
352
palmitic acid
Palmitic acid
ME470208
985
C00249
-
313
nicotinic acid
Nicotinic acid
ME470199
938
C00253
-
180
glyceric acid
Glyceric acid
ME470147
439194
C00258
-
189
homoserine
Homoserine
ME470158
12647
C00263
-
218
aniline
Aniline
ME470095
6115
C00292
-
150
orotic acid
Orotic acid
ME470207
967
C00295
-
254
uridine
Uridine
ME470253
6029
C00299
-
224
xylulose
Xylulose
ME470258
439205
C00312
-
173
spermidine
Spermidine
ME470233
1102
C00315
-
144
D-erythro-sphingosine
Sphingosine
ME470121
5280335
C00319
-
204
2-ketoadipic acid
Oxoadipic acid
ME470054
71
C00322
-
89
4-aminobutyric acid
4-Aminopentanoic acid
ME470075
119
C00334
-
304
phosphoethanolamine
Phosphoethanolamine
ME470216
1015
C00346
-
299
uric acid
Uric acid
ME470252
1175
C00366
-
441
alpha-tocopherol
alpha-Tocopherol
ME470093
638015
C00376
-
237
cytosin
Cytosine
ME470120
597
C00380
-
254
malonic acid
Malonic acid
ME470183
23511544
C00383
-
233
xanthine
Xanthine
ME470255
1188
C00385
-
353
isoleucine
Isoleucine
ME470165
6306
C00407
-
158
5-aminovaleric acid
5-Aminopentanoic acid
ME470081
138
C00431
-
174
N-acetylornithine
N-Acetylornithine
ME470196
439232
C00437
-
174
saccharopine
Saccharopine
ME470227
160556
C00449
-
357
glutaric acid
Glutaric acid
ME470146
23322899
C00489
-
261
raffinose
Raffinose
ME470225
439242
C00492
-
361
shikimic acid
Shikimic acid
ME470230
8742
C00493
-
204
mannonic acid
Mannonic acid
ME470186
3246006
C00514
-
333
4-aminobenzoic acid
p-Aminobenzoic acid
ME470074
7057990
C00568
-
266
N-acetylglutamate
N-Acetylglutamic acid
ME470195
70914
C00624
-
216
4-hydroxyphenylacetic acid
4-Hydroxyphenylacetic acid
ME470078
127
C00642
-
179
N-acetyl-D-mannosamine
N-Acetyl-mannosamine
ME470193
439281
C00645
-
319
malic acid
Malic acid
ME470182
20130941
C00711
-
233
oleic acid
Oleic acid
ME470205
445639
C00712
-
339
sorbitol
Sorbitol
ME470232
5780
C00794
-
217
tagatose
D-Tagatose
ME470237
439312
C00795
-
307
gluconic acid
Gluconic acid
ME470141
6857417
C00800
-
333
salicylic acid
Salicylic acid
ME470228
338
C00805
-
267
citramalic acid
Citramalic acid
ME470116
1081
C00815
-
247
1-hexadecanol
Cetyl alcohol
ME470043
2682
C00823
-
299
4-pyridoxic acid
4-Pyridoxic acid
ME470080
6723
C00847
-
309
aminomalonate
Aminomalonic acid
ME470094
100714
C00872
-
218
mucic acid
Galactaric acid
ME470188
3037582
C00879
-
333
tartaric acid
Tartaric acid
ME470238
444305
C00898
-
292
indole-3-acetate
Indoleacetic acid
ME470161
802
C00954
-
202
alpha-aminoadipic acid
alpha-Aminoadipic acid
ME470091
59066632
C00956
-
260
O-acetylserine
O-Acetylserine
ME470202
6971051
C00979
-
174
4-hydroxybutyric acid
4-Hydroxybutyric acid
ME470077
10413
C00989
-
233
6-hydroxynicotinic acid
6-Hydroxynicotinic acid
ME470085
72924
C01020
-
268
N-acetylaspartic acid
N-Acetylaspartic acid
ME470194
65065
C01042
-
158
trehalose
Trehalose
ME470246
7427
C01083
-
191
3-hydroxybutyric acid
3-Hydroxybutyric acid
ME470065
92135
C01089
-
191
galactose-6-phosphate
Galactose 6-phosphate
ME470138
439404
C01113
-
387
trans-4-hydroxyproline
trans-4-Hydroxyproline
ME470245
5810
C01157
-
158
3,4-dihydroxyphenylacetic acid
3,4-Dihydroxybenzeneacetic acid
ME470072
547
C01161
-
179
dehydrocholesterol
Dehydrocholesterol
ME470122
439423
C01164
-
129
3,4-dihydroxycinnamic acid
Caffeic acid
ME470070
689043
C01197
-
219
maleic acid
Maleic acid
ME470180
444266
C01384
-
245
phytol
Phytol
ME470218
5280435
C01389
-
143
cystine
Cystine
ME470119
24798687
C01420
-
218
lactic acid
Lactic acid
ME470171
19789253
C01432
-
191
ferulic acid
trans-Ferulic acid
ME470132
445858
C01494
-
338
stearic acid
Stearic acid
ME470234
5281
C01530
-
117
capric acid
Capric acid
ME470110
2969
C01571
-
229
linoleic acid
Linoleic acid
ME470177
5280450
C01595
-
150
pelargonic acid
Pelargonic acid
ME470209
8158
C01601
-
215
threonic acid
Threonic acid
ME470240
5460407
C01620
-
292
lanosterol
Lanosterol
ME470173
246983
C01724
-
393
3-(4-hydroxyphenyl)propionic acid
Desaminotyrosine
ME470062
10394
C01744
-
179
beta-sitosterol
Sitosterol
ME470105
222284
C01753
-
129
xanthosine
Xanthosine
ME470256
64959
C01762
-
325
homocystine
DL-Homocystine
ME470157
10010
C01817
-
128
norvaline
Norvaline
ME470201
65098
C01826
-
144
maltotriose
Maltotriose
ME470185
439586
C01835
-
361
2-aminophenol
2-Aminophenol
ME470050
5801
C01987
-
150
pseudouridine
Pseudouridine
ME470222
15047
C02067
-
217
fucose
Fucose
ME470135
439650
C02095
-
160
methylmaleic acid
Citraconic acid
ME470187
643798
C02226
-
259
dodecanol
Dodecanol
ME470127
8193
C02277
-
243
fructose
Fructose
ME470133
439709
C02336
-
307
gamma-tocopherol
gamma-Tocopherol
ME470140
92729
C02483
-
223
2-hydroxyglutaric acid
2-Hydroxyglutaric acid
ME470052
43
C02630
-
247
pimelic acid
Pimelic acid
ME470220
385
C02656
-
155
lauric acid
Lauric acid
ME470174
3893
C02679
-
117
N-acetylputrescine
N-Acetylputrescine
ME470197
122356
C02714
-
174
1,2,4-benzenetriol
1,2,4-Trihydroxybenzene
ME470048
10787
C02814
-
239
guanidinosuccinate
Guanidinosuccinic acid
ME470152
439918
C03139
-
328
glycerol-alpha-phosphate
sn-Glycero-3-phosphate
ME470149
754
C03189
-
357
2,4-diaminobutyric acid
2,4-Diaminobutyric acid
ME470059
134490
C03283
-
174
1-kestose
1-Kestose
ME470044
440080
C03661
-
361
3-hydroxy-3-methylglutaric acid
3-Hydroxymethylglutaric acid
ME470064
1662
C03761
-
247
N-acetyl-d-hexosamine
N-Acetylhexosamine
ME470192
24139
C03878
-
319
N-acetyl-D-galactosamine
N-Acetylgalactosamine
ME470191
440552
C05021
-
319
3-aminoisobutyric acid
3-Aminoisobutanoic acid
ME470063
25201103
C05145
-
102
nicotianamine
(R,S,S)-Nicotianamine
ME470198
49852318
C05324
-
186
phenylethylamine
Phenylethylamine
ME470214
1001
C05332
-
174
fructose-6-phosphate
Fructose 6-phosphate
ME470134
440641
C05345
-
315
beta-glutamic acid
Isoglutamic acid
ME470104
73064
C05574
-
232
3-hydroxyphenylacetic acid
3-Hydroxyphenylacetic acid
ME470067
12122
C05593
-
164
5-methoxytryptamine
5-Methoxytryptamine
ME470083
1833
C05659
-
174
tyrosol
Tyrosol
ME470248
10393
C06044
-
179
adipic acid
Adipic acid
ME470088
196
C06104
-
111
caprylic acid
Caprylic acid
ME470111
379
C06423
-
201
myristic acid
Myristic acid
ME470190
11005
C06424
-
285
arachidic acid
Arachidic acid
ME470096
10467
C06425
-
117
linolenic acid
Octadecatrienoic acid
ME470178
5280934
C06427
-
108
docosahexaenoic acid
Docosahexaenoic acid
ME470126
445580
C06429
-
91
3,6-anhydro-D-galactose
3,6-Anhydro-galactose
ME470073
16069996
C06474
-
231
biphenyl
Biphenyl
ME470107
7095
C06588
-
154
epsilon-caprolactam
Epsilon-caprolactam
ME470131
7768
C06593
-
170
vanillic acid
Vanillic acid
ME470254
8468
C06672
-
297
4-methylcatechol
4-Methylcatechol
ME470079
9958
C06730
-
268
phenylacetic acid
Phenylacetic acid
ME470213
999
C07086
-
164
maleimide
Maleimide
ME470181
10935
C07272
-
154
beta-gentiobiose
beta-Gentiobiose
ME470103
441422
C08240
-
160
sophorose
Sophorose
ME470231
441432
C08250
-
307
azelaic acid
Azelaic acid
ME470100
19347555
C08261
-
317
galacturonic acid
Galacturonic acid
ME470139
441476
C08348
-
333
6-deoxyglucose
Quinovose
ME470084
441480
C08352
-
117
epicatechin
Epicatechin
ME470130
72276
C09727
-
368
3,4-dihydroxyhydrocinnamic acid
3,4-Dihydroxyhydrocinnamic acid
ME470071
348154
C10447
-
179
dihydro-3-coumaric acid
3-(3-Hydroxyphenyl)propanoic acid
ME470124
91
C11457
-
192
phytosphingosine
Phytosphingosine
ME470219
122121
C12144
-
204
dihydrocholesterol
Dihydrocholesterol
ME470125
66066
C12978
-
215
tocopherol acetate
Tocopherol acetate
ME470244
86472
C13202
-
164
octadecylglycerol
MG O-18:0
ME470204
3681
C13858
-
205
hexadecylglycerol
MG O-16:0
ME470155
72733
C13859
-
205
delta-tocopherol
delta-Tocopherol
ME470123
92094
C14151
-
208
beta-tocopherol
beta-tocopherol
ME470106
8989
C14152
-
223
isopropylbenzene
Isopropylbenzene
ME470168
7406
C14396
-
105
cis-gondoic acid
cis-Gondoic acid
ME470115
5282768
C16526
-
367
pentadecanoic acid
Pentadecylic acid
ME470210
13849
C16537
-
117
threitol
Threitol
ME470239
169019
C16884
-
217
enterolactone
Enterolactone
ME470129
114739
C18165
-
180
secoisolariciresinol
Secoisolariciresinol
ME470229
65373
C18167
-
209
5-hydroxymethyl-2-furoic acid
Sumiki's acid
ME470082
80642
C20448
-
123
octadecanol
Stearyl alcohol
ME470203
8221
D01924
-
327
1-monostearin
MG 18:0/0:0/0:0
ME470047
24699
D01947
-
203
1-monoolein
MG 18:1(9Z)/0:0/0:0
ME470045
5283468
No result
-
129
1-monopalmitin
MG 16:0/0:0/0:0
ME470046
14900
No result
-
371
2,3-dihydroxypyridine
2,3-Dihydroxypyridine
ME470058
28115
No result
-
240
2,6-diaminopimelic acid
2,6-Diaminopimelic acid
ME470060
53448507
No result
-
200
2-aminobutyric acid
2-Aminobutyric acid
ME470049
517460
No result
-
130
2-deoxypentitol
2-Deoxy-D-ribitol
ME470051
249377
No result
-
231
2-hydroxyvaleric acid
2-Hydroxyvaleric acid
ME470053
98009
No result
-
131
2-methylglutaric acid
2-Methylglutaric acid
ME470056
12284
No result
-
172
2-monoolein
MG 0:0/18:1(9Z)/0:0
ME470057
5319879
No result
-
129
3-(3-hydroxyphenyl)-3-hydroxypropionic acid
3-(3-Hydroxyphenyl)-3-hydroxypropanoic acid
ME470061
102959
No result
-
267
3-hydroxypalmitic acid
3R-Hydroxypalmitic acid
ME470066
15569776
No result
-
233
3-phenyllactic acid
Phenyllactic acid
ME470068
3848
No result
-
193
alanine-alanine
Ala-Ala
ME470089
5484352
No result
-
116
alloxanoic acid
Alloxanoic acid
ME470090
94146
No result
-
331
butane-2,3-diol
2,3-Butanediol
ME470108
262
No result
-
117
butylamine
Butylamine
ME470109
8007
No result
-
174
cellobiose
Cellobiose
ME470112
294
No result
-
204
cerotinic acid
Cerotic acid
ME470113
10469
No result
-
145
galactinol
Galactinol
ME470137
11727586
No result
-
204
glycyl-proline
Gly-Pro
ME470151
3013625
No result
-
174
heptadecanoic acid
Margaric acid
ME470154
10465
No result
-
117
hexuronic acid
Hexuronic acid
ME470156
152867
No result
-
160
hydroxycarbamate
Hydroxycarbamic acid
ME470159
-
No result
-
278
indole-3-propionic acid
3-Indolepropionic acid
ME470162
3744
No result
-
202
inositol-4-monophosphate
Inositol 4-phosphate
ME470163
440043
No result
-
315
isoheptadecanoic acid
15-Methylpalmitic acid
ME470164
164860
No result
-
117
isolinoleic acid
-
ME470166
5312483
No result
-
156
isopentadecanoic acid
Isopentadecylic acid
ME470167
151014
No result
-
117
isothreonic acid
D-Threonic acid
ME470169
151152
No result
-
292
ketohexose
Ketohexose
ME470170
90008
No result
-
307
lactose
Lactose
ME470172
84571
No result
-
191
levoglucosan
Glucosan
ME470176
2724705
No result
-
204
myo-inositol
Myo-inositol
ME470189
892
No result
-
305
nonadecenoic acid
Nonadecenoic acid
ME470200
5312512
No result
-
117
pentose
Galacturonic acid
ME470211
229
No result
-
103
phytanic acid
Phytanic acid
ME470217
10380830
No result
-
159
piperidone
2-Piperidinone
ME470221
12665
No result
-
156
quinic acid
Quinic acid
ME470224
6508
No result
-
345
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