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Return to study ST002032 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
acyl-C5-OH (hydroxyisovalerylcarnitine)
-
ME471348
-
ac107
-
-
acyl-C18:2-OH
CAR 18:2;OH
ME471360
-
ac123
-
-
acyl-C20:4
CAR 20:4
ME471361
-
ac125
-
-
Phosphate
Phosphoric acid
ME471310
-
C00009
-
-
L-glutamate
Glutamic acid
ME471287
-
C00025
-
-
L-alanine
Alanine
ME471283
-
C00041
-
-
L-lysine
Lysine
ME471291
-
C00047
-
-
L-aspartate
Aspartic acid
ME471286
-
C00049
-
-
Glutathione
Glutathione
ME471311
-
C00051
-
-
L-arginine
Arginine
ME471284
-
C00062
-
-
L-glutamine
Glutamine
ME471288
-
C00064
-
-
L-serine
Serine
ME471295
-
C00065
-
-
L-methionine
Methionine
ME471292
-
C00073
-
-
L-tryptophan
Tryptophan
ME471297
-
C00078
-
-
L-phenylalanine
Phenylalanine
ME471293
-
C00079
-
-
L-tyrosine
Tyrosine
ME471298
-
C00082
-
-
IDP
IDP
ME471302
-
C00104
-
-
Anthranilate
2-Aminobenzoic acid
ME471335
-
C00108
-
-
L-leucine/isoleucine
Leucine/Isoleucine
ME471290
-
C00123
-
-
Glutathione disulfide
Oxidized glutathione
ME471312
-
C00127
-
-
L-histidine
Histidine
ME471289
-
C00135
-
-
L-proline
Proline
ME471294
-
C00148
-
-
L-asparagine
Asparagine
ME471285
-
C00152
-
-
Nicotinamide
Niacinamide
ME471309
-
C00153
-
-
L-valine
Valine
ME471299
-
C00183
-
-
L-threonine
Threonine
ME471296
-
C00188
-
-
Taurine
Taurine
ME471328
-
C00245
-
-
Pyridoxal
Pyridoxal
ME471307
-
C00250
-
-
Creatine
Creatine
ME471321
-
C00300
-
-
Spermidine
Spermidine
ME471319
-
C00315
-
-
L-Carnitine
Carnitine
ME471342
-
C00318
-
-
Sphingosine
Sphingosine
ME471339
-
C00319
-
-
L-Citrulline
Citrulline
ME471318
-
C00327
-
-
kynurenine
Kynurenine
ME471334
-
C00328
-
-
Cytosine
Cytosine
ME471301
-
C00380
-
-
5-6-Dihydrouracil
Dihydrouracil
ME471327
-
C00429
-
-
N-Acetylornithine
N-Acetylornithine
ME471323
-
C00437
-
-
Indole
Indole
ME471330
-
C00463
-
-
L-cystine
Cystine
ME471300
-
C00491
-
-
Allantoate
Allantoic acid
ME471303
-
C00499
-
-
Guanidinoacetate
Guanidoacetic acid
ME471324
-
C00581
-
-
Indole-3-acetaldehyde
Indoleacetaldehyde
ME471331
-
C00637
-
-
Pyridoxamine 5'-phosphate
Pyridoxamine 5'-phosphate
ME471308
-
C00647
-
-
Serotonin
Serotonin
ME471336
-
C00780
-
-
Creatinine
Creatinine
ME471322
-
C00791
-
-
Pantothenol
Pantothenol
ME471326
-
C00864
-
-
5-6-Dihydrothymine
Dihydrothymine
ME471306
-
C00906
-
-
Indole-3-acetate
Indoleacetic acid
ME471332
-
C00954
-
-
Dimethylglycine
Dimethylglycine
ME471315
-
C01026
-
-
trans-4-Hydroxy-L-proline
trans-4-Hydroxyproline
ME471325
-
C01157
-
-
N-Methylethanolamine phosphate
N-Methylethanolamine phosphate
ME471338
-
C01210
-
-
Ornithine
Ornithine
ME471317
-
C01602
-
-
5-Oxoproline
Pyroglutamic acid
ME471313
-
C01879
-
-
Acetylcholine
Acetylcholine
ME471341
-
C01996
-
-
2',3'-Cyclic CMP
2',3' cyclic CMP
ME471305
-
C02354
-
-
Phosphoserine
Phosphoserine
ME471316
-
C02532
-
-
acetyl-carnitine (acyl-C2)
CAR 2:0
ME471343
-
C02571
-
-
L-octanoylcarnitine (acyl-C8)
CAR 8:0
ME471350
-
C02838
-
-
butanoyl-l-carnitine (acyl-C4)
CAR 4:0
ME471345
-
C02862
-
-
L-Methionine S-oxide
Methionine sulfoxide
ME471329
-
C02989
-
-
L-Palmitoylcarnitine (acyl-C16)
CAR 16:0
ME471356
-
C02990
-
-
propionyl-carnitine (acyl-C3)
CAR 3:0
ME471344
-
C03017
-
-
5-Guanidino-2-oxopentanoate
2-Oxoarginine
ME471320
-
C03771
-
-
S-Glutathionyl-L-cysteine
S-Glutathionyl-cysteine
ME471314
-
C05526
-
-
Indoxyl
Indoxyl
ME471333
-
C05658
-
-
Sphingosine 1-phosphate
Sphingosine 1-phosphate
ME471340
-
C06124
-
-
Ectoine
Ectoine
ME471337
-
C06231
-
-
5-Hydroxyisourate
5-Hydroxyisouric acid
ME471304
-
C11821
-
-
O-Decenoyl-L-carnitine (acyl-C10:1)
-
ME471351
-
CID57357170
-
-
hexanoyl-L-carnitine (acyl-C6)
CAR 6:0
ME471349
-
HMDB00756
-
-
acyl-C18:2 (Linoleoyl-CoA)
Linoleoyl-CoA
ME471359
-
HMDB01064
-
-
O-dodecanoyl-carnitine (acyl-C12)
CAR 12:0
ME471352
-
HMDB02250
-
-
acyl-C5:1 (Tiglylcarnitine)
CAR 5:1
ME471347
-
HMDB02366
-
-
O-tetradecanoyl-L-carnitine (acyl-C14)
CAR 14:0
ME471354
-
HMDB05066
-
-
Hexadecenoyl-carnitine (acyl-C16:1)
CAR 16:1
ME471357
-
HMDB06317
-
-
O-octadecenoyl-L-carnitine (acyl-C18:1)
CAR 18:1
ME471358
-
HMDB06351
-
-
acyl-C4-OH (Hydroxybutyrylcarnitine)
CAR 4:0;OH
ME471346
-
HMDB13127
-
-
O-dodecenoyl-carnitine (acyl-C12:1)
CAR 12:1
ME471353
-
HMDB13326
-
-
Tetradecenoyl Carnitine (acyl-C14:1)
CAR 14:1
ME471355
-
HMDB13329
-
-
Analysis: Reversed phase NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
Diphosphate
Pyrophosphate
ME471372
-
C00013
-
-
Pyruvate
Pyruvic acid
ME471379
-
C00022
-
-
2-Oxoglutarate
2-Oxoglutaric acid
ME471386
-
C00026
-
-
D-Glucose
Glucose
ME471373
-
C00031
-
-
Succinate
Succinic acid
ME471388
-
C00042
-
-
CMP
CMP
ME471364
-
C00055
-
-
Ascorbate
Vitamin C
ME471394
-
C00072
-
-
Phosphoenolpyruvate
Phosphoenolpyruvic acid
ME471378
-
C00074
-
-
Glycerol 3-phosphate
sn-Glycero-3-phosphate
ME471416
-
C00093
-
-
Tetrahydrofolate
THF
ME471399
-
C00101
-
-
D-Glyceraldehyde 3-phosphate/Glycerone phosphate
Glyceraldehyde 3-phosphate
ME471375
-
C00118
-
-
D-Ribose
Ribose
ME471382
-
C00121
-
-
Fumarate
Fumaric acid
ME471389
-
C00122
-
-
CMP-N-acetylneuraminate
CMP-N-acetylneuraminic acid
ME471404
-
C00128
-
-
Adenine
Adenine
ME471363
-
C00147
-
-
Malate
Malic acid
ME471390
-
C00149
-
-
Citrate
Citric acid
ME471385
-
C00158
-
-
Thymine
Thymine
ME471366
-
C00178
-
-
Thymidine
Thymidine
ME471365
-
C00214
-
-
Arachidonic acid (Eicosatetraenoic acid)
Eicosatetraenoic acid
ME471433
-
C00219
-
-
1/2-3-Bisphosphoglycerate
3-Phospho-D-glyceroyl dihydrogen phosphate
ME471376
-
C00236
-
-
Hexadecanoic acid (palmitic acid)
Palmitic acid
ME471426
-
C00249
-
-
N-Acetylneuraminate
N-Acetylneuraminic acid
ME471400
-
C00270
-
-
Inosine
Inosine
ME471367
-
C00294
-
-
Thiosulfate
-
ME471408
-
C00320
-
-
Indolepyruvate
Indolepyruvate
ME471412
-
C00331
-
-
Ethanolamine phosphate
Phosphoethanolamine
ME471417
-
C00346
-
-
dAMP
dAMP
ME471362
-
C00360
-
-
Urate
Uric acid
ME471370
-
C00366
-
-
Xanthine
Xanthine
ME471368
-
C00385
-
-
Mannitol/Sorbitol
Sorbitol
ME471381
-
C00392/C00794
-
-
Bilirubin
Bilirubin
ME471442
-
C00486
-
-
L-Cysteate
Cysteic acid
ME471410
-
C00506
-
-
alpha-D-Ribose 1-phosphate
Ribose 1-phosphate
ME471393
-
C00620
-
-
2/3-Phospho-D-glycerate
2-Phosphoglyceric acid
ME471377
-
C00631
-
-
Octadecenoic acid (Oleic acid)
Oleic acid
ME471430
-
C00712
-
-
2-Oxoglutaramate
2-Keto-glutaramic acid
ME471387
-
C00940
-
-
3',5'-Cyclic IMP
3',5' cyclic IMP
ME471371
-
C00943
-
-
Sphinganine 1-phosphate
Sphinganine 1-phosphate
ME471418
-
C01120
-
-
Lactate
Lactic acid
ME471380
-
C01432
-
-
Octadecanoic acid (stearic acid)
Stearic acid
ME471427
-
C01530
-
-
Decanoic acid (capric acid)
Capric acid
ME471423
-
C01571
-
-
Hexanoic acid (caproate)
Caproic acid
ME471419
-
C01585
-
-
Linoleic acid ((9Z,12Z)-Octadecadienoic acid)
Linoleic acid
ME471431
-
C01595
-
-
Nonanoic acid (pelargonic acid)
Pelargonic acid
ME471422
-
C01601
-
-
D-Rhamnose
Rhamnose
ME471383
-
C01684
-
-
D-Arabitol
Arabitol
ME471384
-
C01904
-
-
Phosphocreatine
Phosphocreatine
ME471405
-
C02305
-
-
(S)(+)-Allantoin
Allantoin
ME471369
-
C02350
-
-
1-4-beta-D-Xylan
-
ME471403
-
C02352
-
-
2-Hydroxyglutarate/Citramalate
2-Hydroxyglutaric acid
ME471391
-
C02630
-
-
Dodecanedioic acid
Dodecanedioic acid
ME471436
-
C02678
-
-
Dodecanoic acid (lauric acid)
Lauric acid
ME471424
-
C02679
-
-
4-Acetamidobutanoate
4-Acetamidobutanoic acid
ME471406
-
C02946
-
-
D-Glucose 6/1-phosphate
Hexose 6-phosphate
ME471374
-
C02965
-
-
Dihomo-gamma-linolenic acid ((8Z-11Z-14Z)-Icosatri...
Dihomo-gamma-linolenic acid
ME471439
-
C03242
-
-
N-Glycoloyl-neuraminate
N-Glycoloylneuraminic acid
ME471401
-
C03410
-
-
gamma-L-Glutamyl-D-alanine
gamma-L-Glutamyl-D-alanine
ME471396
-
C03738
-
-
3D-(3-5/4)-Trihydroxycyclohexane-1-2-dione
-
ME471415
-
C04287
-
-
(5-L-Glutamyl)-L-glutamine
gamma-Glutamylglutamine
ME471397
-
C05283
-
-
Dehydroascorbate
L-Dehydroascorbic acid
ME471395
-
C05422
-
-
5-Hydroxyindoleacetate
5-Hydroxyindoleacetic acid
ME471411
-
C05635
-
-
8-Methoxykynurenate
-
ME471414
-
C05830
-
-
5-L-Glutamyl-taurine
5-L-Glutamyl-taurine
ME471398
-
C05844
-
-
N-Succinyl-L-glutamate 5-semialdehyde
-
ME471407
-
C05932
-
-
alpha-D-Glucosamine 1-phosphate
Glucosamine 1-phosphate
ME471402
-
C06156
-
-
Sedoheptulose 1/7-phosphate
-
ME471392
-
C06222
-
-
3-Sulfocatechol
3-Sulfocatechol
ME471409
-
C06336
-
-
Octanoic acid (caprylic acid)
Caprylic acid
ME471421
-
C06423
-
-
Tetradecanoic acid (myristic acid)
Myristic acid
ME471425
-
C06424
-
-
a-Linolenic acid (Octadecatrienoic acid)
Octadecatrienoic acid
ME471432
-
C06427
-
-
Eicosapentaenoic acid
Eicosapentaenoic acid
ME471438
-
C06428
-
-
Docosahexaenoic acid
Docosahexaenoic acid
ME471435
-
C06429
-
-
Tetradecenoic acid (myristoleic acid)
Myristoleic acid
ME471428
-
C08322
-
-
Hexadecenoic acid (Palmitoleic acid)
Palmitoleic acid
ME471429
-
C08362
-
-
6-Hydroxykynurenic acid
6-Hydroxykynurenic acid
ME471413
-
C08480
-
-
Stearidonic acid ((6Z,9Z,12Z,15Z)-Octadecatetraeno...
Stearidonic acid
ME471434
-
C16300
-
-
Docosapentaenoic acid ((7Z-10Z-13Z-16Z-19Z)-Docosa...
DPA
ME471440
-
C16513
-
-
Adrenic acid (7,10,13,16-Docosatetraenoic acid)
Adrenic acid
ME471437
-
C16527
-
-
Heptanoic acid
Heptylic acid
ME471420
-
C17714
-
-
Undecanoic acid
Undecylic acid
ME471441
-
C17715
-
-
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