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Return to study ST001243 main page
Analysis: Reversed phase POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
Dimethylglycine
Dimethylglycine
ME292361
-
C01026
-
104.0706
Choline
Choline
ME292384
-
C00114
-
105.1133
L-serine
Serine
ME292342
-
C00065
-
106.0498
Uracil
Uracil
ME292349
-
C00106
-
113.0343
Creatinine
Creatinine
ME292367
-
C00791
-
114.0661
L-proline
Proline
ME292341
-
C00148
-
116.0704
Hexanoic acid
Caproic acid
ME292394
-
C01585
-
117.0909
Indole
Indole
ME292375
-
C00463
-
118.0651
L-valine
Valine
ME292346
-
C00183
-
118.086
L-threonine
Threonine
ME292343
-
C00188
-
120.0654
L-cysteine
Cysteine
ME292333
-
C00097
-
122.0267
Picolinic acid
Picolinic acid
ME292379
-
C10164
-
124.0402
Taurine
Taurine
ME292371
-
C00245
-
126.0215
5-Oxoproline
Pyroglutamic acid
ME292356
-
C01879
-
130.0496
trans-4-Hydroxy-L-proline
trans-4-Hydroxyproline
ME292370
-
C01157
-
132.0653
Creatine
Creatine
ME292366
-
C00300
-
132.0762
L-leucine
Leucine
ME292337
-
C00123
-
132.1015
L-asparagine
Asparagine
ME292331
-
C00152
-
133.0603
Ornithine
Ornithine
ME292363
-
C00077
-
133.0967
L-Aspartate
Aspartic acid
ME292332
-
C00049
-
134.0442
L-Homocysteine
Homocysteine
ME292360
-
C00155
-
136.042
Adenine
Adenine
ME292348
-
C00147
-
136.0614
Hypoxanthine
Hypoxanthine
ME292351
-
C00262
-
137.0451
Anthranilate
2-Aminobenzoic acid
ME292396
-
C00108
-
138.0545
3-Methyleneoxindole
3-Methyleneoxindole
ME292374
-
C02796
-
146.0595
4-Acetamidobutanoate
4-Acetamidobutanoic acid
ME292368
-
C02946
-
146.0807
Acetylcholine
Acetylcholine
ME292383
-
C01996
-
146.117
L-glutamine
Glutamine
ME292335
-
C00064
-
147.0759
L-lysine
Lysine
ME292338
-
C00047
-
147.1122
L-glutamate
Glutamic acid
ME292334
-
C00025
-
148.0596
L-methionine
Methionine
ME292339
-
C00073
-
150.0576
Xanthine
Xanthine
ME292352
-
C00385
-
153.0401
L-histidine
Histidine
ME292336
-
C00135
-
156.0762
g-Oxalo-crotonate
4-Oxalocrotonic acid
ME292380
-
C03453
-
159.0272
Indole-3-acetaldehyde
Indoleacetaldehyde
ME292376
-
C00637
-
160.0751
L-Carnitine
Carnitine
ME292385
-
C00318
-
163.1187
L-Methionine S-oxide
Methionine sulfoxide
ME292372
-
C02989
-
166.0527
L-phenylalanine
Phenylalanine
ME292340
-
C00079
-
166.0857
Quinolinic acid
Quinolinic acid
ME292397
-
C03722
-
168.0292
Pyridoxal
Pyridoxal
ME292354
-
C00250
-
168.0627
5-Guanidino-2-oxopentanoate
2-Oxoarginine
ME292365
-
C03771
-
174.0869
N-Acetylornithine
N-Acetylornithine
ME292369
-
C00437
-
175.1072
L-arginine
Arginine
ME292330
-
C00062
-
175.1182
Indole-3-acetate
Indoleacetic acid
ME292377
-
C00954
-
176.0702
L-Citrulline
Citrulline
ME292364
-
C00327
-
176.1022
Allantoate
Allantoic acid
ME292353
-
C00499
-
177.0603
Serotonin
Serotonin
ME292395
-
C00780
-
177.1016
Cys-Gly
Cys-Gly
ME292357
-
C01419
-
179.0476
L-tyrosine
Tyrosine
ME292345
-
C00082
-
182.0803
L-Adrenaline
Epinephrine
ME292381
-
C00788
-
184.0937
5-Hydroxyindoleacetate
5-Hydroxyindoleacetic acid
ME292373
-
C05635
-
192.0645
L-tryptophan
Tryptophan
ME292344
-
C00078
-
205.0962
kynurenine
Kynurenine
ME292378
-
C00328
-
209.0912
gamma-L-Glutamyl-D-alanine
gamma-L-Glutamyl-D-alanine
ME292358
-
C03738
-
219.0969
L-cystine
Cystine
ME292347
-
C00491
-
241.0295
Tiglylcarnitine
CAR 4:1;2Me
ME292387
-
-
-
244.1538
Isovalerylcarnitine
CAR 4:0;3Me
ME292393
-
-
-
246.1694
Hydroxybutyrylcarnitine
CAR 4:0;OH
ME292386
-
-
-
248.1467
Pyridoxamine phosphate
Pyridoxamine 5'-phosphate
ME292355
-
C00647
-
249.06
hexanoyl-L-carnitine
CAR 6:0
ME292388
-
-
-
260.1851
Inosine
Inosine
ME292350
-
C00294
-
269.0866
(5-L-Glutamyl)-L-glutamine
gamma-Glutamylglutamine
ME292359
-
C05283
-
276.1174
octenoyl-l-carnitine
CAR 8:1
ME292389
70679121
-
-
286.2006
O-Decenoyl-L-carnitine
CAR 10:1
ME292391
57357170
-
-
314.231
O-Decanoyl-L-carnitine
CAR 10:0
ME292390
-
-
-
316.2469
O-dodecenoyl-carnitine
CAR 12:1
ME292392
-
-
-
342.2622
Sphingosine 1-phosphate
Sphingosine 1-phosphate
ME292382
-
C06124
-
380.2541
L-Alanine
Alanine
ME292329
-
C00041
-
90.05525
Sarcosine
Sarcosine
ME292362
-
C00213
-
90.05527
Analysis: Reversed phase NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
Fumarate
Fumaric acid
ME292409
-
C00122
-
115.0019
Succinate
Succinic acid
ME292408
-
C00042
-
117.0176
L-1-Pyrroline-3-hydroxy-5-carboxylate
-
ME292417
-
C04281
-
128.0334
Oxaloacetate
Oxaloacetic acid
ME292411
-
C00036
-
130.9999
1-4-beta-D-Xylan
-
ME292416
-
C02352
-
131.0332
Malate
Malic acid
ME292410
-
C00149
-
133.0126
Octanoic acid
Caprylic acid
ME292419
-
C06423
-
143.1057
2-Oxoglutarate
2-Oxoglutaric acid
ME292407
-
C00026
-
145.0129
2-Hydroxyglutarate
2-Hydroxyglutaric acid
ME292412
-
C02630
-
147.0283
D-Ribose
Ribose
ME292405
-
C00121
-
149.044
Urate
Uric acid
ME292398
-
C00366
-
167.0195
Dehydroascorbate
Dehydroascorbic acid
ME292415
-
C05422
-
173.0078
Ascorbate
Vitamin C
ME292414
-
C00072
-
175.0234
D-Glucose
Glucose
ME292401
-
C00031
-
179.0547
Mannitol
Mannitol
ME292404
-
C00392
-
181.0704
3-Sulfocatechol
3-Sulfocatechol
ME292418
-
C06336
-
188.9848
Citrate
Citric acid
ME292406
-
C00158
-
191.0182
alpha-D-Ribose 1-phosphate
Ribose 1-phosphate
ME292413
-
C00620
-
229.0112
2',3'-Cyclic CMP
2',3' cyclic CMP
ME292399
-
C02354
-
304.0353
Pyruvate
Pyruvic acid
ME292402
-
C00022
-
87.00687
Lactate
Lactic acid
ME292403
-
C00186
-
89.02254
Phosphate
Phosphoric acid
ME292400
-
C00009
-
96.96776
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