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Return to study ST002714 main page
Analysis: Reversed phase NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
1-3-Bisphosphoglycerate
3-Phospho-D-glyceroyl dihydrogen phosphate
ME641139
-
C00236
-
264.9525
2',3'-Cyclic CMP
2',3' cyclic CMP
ME641132
-
C02354
-
304.0368
2/3-Phospho-D-glycerate
2-Phosphoglyceric acid
ME641140
-
C00631
-
184.9845
2-Hydroxyglutarate/Citramalate
2-Hydroxyglutaric acid
ME641154
-
C02630
-
147.0288
2-Oxoglutaramate
2-Keto-glutaramic acid
ME641150
-
C00940
-
144.0289
2-Oxoglutarate
2-Oxoglutaric acid
ME641149
-
C00026
-
145.0128
3',5'-Cyclic AMP
3',5' cyclic AMP
ME641131
-
C00575
-
328.0449
3-Phosphonooxypyruvate
Phosphohydroxypyruvic acid
ME641163
-
C03232
-
182.9668
4-Acetamidobutanoate
4-Acetamidobutanoic acid
ME641170
-
C02946
-
144.0653
5-6-Dihydrothymine
Dihydrothymine
ME641133
-
C00906
-
127.0498
5-Hydroxyindoleacetate
5-Hydroxyindoleacetic acid
ME641176
-
C05635
-
190.0532
5-L-Glutamyl-taurine
5-L-Glutamyl-taurine
ME641162
-
C05844
-
253.0493
(7Z-10Z-13Z-16Z-19Z)-Docosa-7-10-13-16-19-pentaeno...
DPA
ME641197
-
C16513
-
329.2484
(8Z-11Z-14Z)-Icosatrienoic acid
Dihomo-gamma-linolenic acid
ME641196
-
C03242
-
305.2482
Adenine
Adenine
ME641122
-
C00147
-
134.0459
ADP
ADP
ME641121
-
C00008
-
426.0217
alpha-D-Glucosamine 1-phosphate
Glucosamine 1-phosphate
ME641165
-
C06156
-
258.0378
alpha-D-Ribose 1-phosphate
Ribose 1-phosphate
ME641156
-
C00620
-
229.0112
Ascorbate
Vitamin C
ME641158
-
C00072
-
175.0238
ATP
ATP
ME641120
-
C00002
-
505.9877
Bis-gamma-glutamylcystine
Bis-gamma-glutamylcystine
ME641161
-
C03646
-
497.0922
Butanoic acid
Butyric acid
ME641183
-
C00246
-
87.0435
Carnosine
Carnosine
ME641169
-
C00386
-
225.0985
CDP-choline
CDP-choline
ME641182
-
C00307
-
487.0992
Citrate
Citric acid
ME641148
-
C00158
-
191.0186
CMP-N-acetylneuraminate
CMP-N-acetylneuraminic acid
ME641167
-
C00128
-
613.1389
D-Arabitol
Arabitol
ME641147
-
C01904
-
151.0601
dCMP
dCMP
ME641123
-
C00239
-
306.048
Dehydroascorbate
Dehydroascorbic acid
ME641159
-
C05422
-
173.0079
D-Erythrose 4-phosphate
Erythrose 4-phosphate
ME641155
-
C00279
-
199.0004
D-Fructose 1-6-bisphosphate
Fructose 1,6-bisphosphate
ME641138
-
C00354
-
338.9883
D-Glucose
Glucose
ME641137
-
C00031
-
179.0549
Diphosphate
Pyrophosphate
ME641136
-
C00013
-
176.9343
Docosahexaenoic acid
Docosahexaenoic acid
ME641195
-
C06429
-
327.2325
Dodecanoic acid
Lauric acid
ME641185
-
C02679
-
199.1696
D-Rhamnose
Rhamnose
ME641146
-
C01684
-
163.0601
D-Ribose
Ribose
ME641145
-
C00121
-
149.0451
dTMP
dTMP
ME641124
-
C00364
-
321.0497
Eicosapentaenoic acid
Eicosapentaenoic acid
ME641194
-
C06428
-
301.2169
Eicosatetraenoic acid
Eicosatetraenoic acid
ME641193
-
C00219
-
303.2325
Ethanolamine phosphate
Phosphoethanolamine
ME641179
-
C00346
-
140.0105
Fumarate
Fumaric acid
ME641152
-
C00122
-
115.0021
gamma-L-Glutamyl-D-alanine
gamma-L-Glutamyl-D-alanine
ME641160
-
C03738
-
217.082
Glycerol 3-phosphate
sn-Glycero-3-phosphate
ME641178
-
C00093
-
171.0051
Hexadecanoic acid
Palmitic acid
ME641187
-
C00249
-
255.2325
Hexanoic acid (caproate)
Caproic acid
ME641184
-
C01585
-
115.0751
Homocarnosine
Homocarnosine
ME641168
-
C00884
-
239.1145
Lactate
Lactic acid
ME641142
-
C01432
-
89.02284
Linoleate
Linoleic acid
ME641191
-
C01595
-
279.2325
Malate
Malic acid
ME641153
-
C00149
-
133.0127
Maltose
Maltose
ME641143
-
C00208
-
341.1083
Mannitol
Mannitol
ME641144
-
C00392
-
181.0698
N-Acetylneuraminate
N-Acetylneuraminic acid
ME641164
-
C00270
-
308.0981
N-Acetylornithine
N-Acetylornithine
ME641171
-
C00437
-
173.0918
N-Methylethanolamine phosphate
N-Methylethanolamine phosphate
ME641180
-
C01210
-
154.0257
Octadecanoic acid
Stearic acid
ME641188
-
C01530
-
283.2637
Octadecatrienoic acid
Octadecatrienoic acid
ME641192
-
C06427
-
277.2169
Octadecenoic acid
Octadecenoic acid
ME641190
-
C00712
-
281.2481
Pantetheine
Pantetheine
ME641174
-
C00831
-
277.1224
Pantothenol
Pantothenol
ME641173
-
C00864
-
218.1026
Pyridoxamine 5'-phosphate
Pyridoxamine 5'-phosphate
ME641134
-
C00647
-
247.048
Pyruvate
Pyruvic acid
ME641141
-
C00022
-
87.00726
quinolinic acid
Quinolinic acid
ME641177
-
C03722
-
166.0165
(S)(+)-Allantoin
Allantoin
ME641129
-
C02350
-
157.0353
S-Glutathionyl-L-cysteine
S-Glutathionyl-cysteine
ME641157
-
C05526
-
425.08
Sphingosine 1-phosphate
Sphingosine 1-phosphate
ME641181
-
C06124
-
378.2395
Succinate
Succinic acid
ME641151
-
C00042
-
117.0177
Taurine
Taurine
ME641175
-
C00245
-
124.0059
Tetradecanoic acid
Myristic acid
ME641186
-
C06424
-
227.2011
Tetradecenoic acid
Tetradecenoic acid
ME641189
-
C08322
-
225.1855
Thymidine
Thymidine
ME641125
-
C00214
-
241.0814
trans-4-Hydroxy-L-proline
trans-4-Hydroxyproline
ME641172
-
C01157
-
130.0495
UDP
UDP
ME641126
-
C00015
-
402.9987
UDP-glucose
UDP-glucose
ME641135
-
C00029
-
565.0468
UDP-N-acetyl-D-glucosamine
UDP-N-acetylglucosamine
ME641166
-
C00043
-
606.0739
UMP
UMP
ME641127
-
C00105
-
323.0279
Urate
Uric acid
ME641130
-
C00366
-
167.0197
Xanthine
Xanthine
ME641128
-
C00385
-
151.025
Analysis: Reversed phase POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
2-Aminomuconate
2-Aminomuconic acid
ME641260
-
C02220
-
158.045
3-Sulfocatechol
3-Sulfocatechol
ME641254
-
C06336
-
191.0012
5-10-Methenyltetrahydrofolate
5,10-Methenyl-THF
ME641244
-
C00445
-
457.1662
5-6-Dihydrouracil
Dihydrouracil
ME641252
-
C00429
-
115.0504
5-Guanidino-2-oxopentanoate
2-Oxoarginine
ME641249
-
C03771
-
174.0877
5-Hydroxyisourate
5-Hydroxyisouric acid
ME641228
-
C11821
-
185.0323
(5-L-Glutamyl)-L-glutamine
gamma-Glutamylglutamine
ME641238
-
C05283
-
276.1191
5-Oxoproline
Pyroglutamic acid
ME641233
-
C01879
-
130.0501
Acetylcholine
Acetylcholine
ME641264
-
C01996
-
146.1179
acyl-C16:1 (Hexadecenoyl-carnitine)
CAR 16:1
ME641268
-
HMDB06317
-
398.3272
acyl-C4-OH (Hydroxybutyrylcarnitine)
CAR 4:0;OH
ME641265
-
HMDB13127
-
248.1493
acyl-C5-OH
CAR 5:0;OH
ME641266
-
ac107
-
262.1649
acyl-C6 (hexanoyl-l-carnitine)
CAR 6:0
ME641267
-
HMDB00756
-
260.1856
Adenosine
Adenosine
ME641216
-
C00212
-
268.1037
ADP-D-ribose
ADP-ribose
ME641230
-
C01882
-
560.0765
Allantoate
Allantoic acid
ME641227
-
C00499
-
177.0589
CMP
CMP
ME641219
-
C00055
-
324.0591
Creatinine
Creatinine
ME641250
-
C00791
-
114.0664
Cys-Gly
Cys-Gly
ME641234
-
C01419
-
179.0488
Cystathionine
Cystathionine
ME641239
-
C00542
-
223.0749
Cytidine
Cytidine
ME641220
-
C00475
-
244.093
Cytosine
Cytosine
ME641221
-
C00380
-
112.0507
Dimethylglycine
Dimethylglycine
ME641240
-
C01026
-
104.0707
Dopamine
Dopamine
ME641261
-
C03758
-
154.0866
gamma-Glutamyl-gamma-aminobutyrate
4-(Glutamylamino) butanoate
ME641236
-
C15767
-
233.1133
gamma-L-Glutamyl-L-cysteine
gamma-Glutamylcysteine
ME641235
-
C00669
-
251.0694
gamma-L-Glutamylputrescine
gamma-Glutamylputrescine
ME641237
-
C15699
-
218.1502
Glutathione
Glutathione
ME641231
-
C00051
-
308.0913
Glutathione disulfide
Oxidized glutathione
ME641232
-
C00127
-
613.1599
glycine
Glycine
ME641204
-
C00037
-
76.03951
GMP
GMP
ME641217
-
C00144
-
364.0655
g-Oxalo-crotonate
4-Oxalocrotonic acid
ME641259
-
C03453
-
159.0278
Guanidinoacetate
Guanidoacetic acid
ME641251
-
C00581
-
118.0612
Guanosine
Guanosine
ME641218
-
C00387
-
284.099
Hypotaurine
Hypotaurine
ME641253
-
C00519
-
110.0272
Hypoxanthine
Hypoxanthine
ME641226
-
C00262
-
137.046
IMP
IMP
ME641224
-
C00130
-
349.0547
Indole
Indole
ME641256
-
C00463
-
118.0654
Indole-3-acetaldehyde
Indoleacetaldehyde
ME641257
-
C00637
-
160.076
Inosine
Inosine
ME641225
-
C00294
-
269.088
L-alanine
Alanine
ME641198
-
C00041
-
90.05515
L-arginine
Arginine
ME641199
-
C00062
-
175.1192
L-asparagine
Asparagine
ME641200
-
C00152
-
133.0609
L-aspartate
Aspartic acid
ME641201
-
C00049
-
134.0449
L-Citrulline
Citrulline
ME641246
-
C00327
-
176.1034
L-Cysteate
Cysteic acid
ME641255
-
C00506
-
170.0125
L-glutamate
Glutamic acid
ME641202
-
C00025
-
148.0606
L-glutamine
Glutamine
ME641203
-
C00064
-
147.0768
L-histidine
Histidine
ME641205
-
C00135
-
156.0771
L-leucine
Leucine
ME641206
-
C00123
-
132.1022
L-lysine
Lysine
ME641207
-
C00047
-
147.1132
L-methionine
Methionine
ME641208
-
C00073
-
150.0586
L-phenylalanine
Phenylalanine
ME641209
-
C00079
-
166.0866
L-proline
Proline
ME641210
-
C00148
-
116.0707
L-serine
Serine
ME641211
-
C00065
-
106.05
L-threonine
Threonine
ME641212
-
C00188
-
120.0658
L-tryptophan
Tryptophan
ME641213
-
C00078
-
205.0975
L-tyrosine
Tyrosine
ME641214
-
C00082
-
182.0814
L-valine
Valine
ME641215
-
C00183
-
118.0863
Nicotinamide
Niacinamide
ME641229
-
C00153
-
123.0554
Ornithine
Ornithine
ME641245
-
C01602
-
133.0975
Phosphoserine
Phosphoserine
ME641241
-
C02532
-
186.0171
Picolinic acid
Picolinic acid
ME641258
-
C10164
-
124.0405
Putrescine
Putrescine
ME641247
-
C00134
-
89.10743
S-Adenosyl-L-homocysteine
S-Adenosylhomocysteine
ME641242
-
C00021
-
385.1289
S-Adenosyl-L-methionine
S-Adenosylmethionine
ME641243
-
C00019
-
399.1446
Serotonin
Serotonin
ME641262
-
C00780
-
177.1025
Spermine
Spermine
ME641248
-
C00750
-
203.2234
Sphingosine
Sphingosine
ME641263
-
C00319
-
300.2897
Thymine
Thymine
ME641222
-
C00178
-
127.0504
Uracil
Uracil
ME641223
-
C00106
-
113.035
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