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Return to study ST002037 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
Anthranilate
2-Aminobenzoic acid
ME472246
-
-
-
-
gamma-Glutamyl-gamma-aminobutyrate
4-(Glutamylamino) butanoate
ME472213
-
-
-
-
g-Oxalo-crotonate
4-Oxalocrotonic acid
ME472248
-
-
-
-
5-Hydroxyindoleacetate
5-Hydroxyindoleacetic acid
ME472240
-
-
-
-
5-Hydroxyisourate
5-Hydroxyisouric acid
ME472200
-
-
-
-
6-Phospho-D-gluconate
6-Phosphogluconic acid
ME472207
-
-
-
-
Acetylcholine
Acetylcholine
ME472255
-
-
-
-
Adenine
Adenine
ME472192
-
-
-
-
Adenosine
Adenosine
ME472191
-
-
-
-
L-alanine
Alanine
ME472172
-
-
-
-
Allantoate
Allantoic acid
ME472199
-
-
-
-
AMP
AMP
ME472190
-
-
-
-
Argininosuccinate
Argininosuccinic acid
ME472224
-
-
-
-
L-asparagine
Asparagine
ME472173
-
-
-
-
L-aspartate
Aspartic acid
ME472174
-
-
-
-
O-tetradecanoyl-L-carnitine (acyl-C14)
CAR 14:0
ME472268
-
-
-
-
Tetradecenoyl Carnitine (acyl-C14:1)
CAR 14:1
ME472269
-
-
-
-
L-Palmitoylcarnitine (acyl-C16)
CAR 16:0
ME472270
-
-
-
-
Hexadecenoyl-carnitine (acyl-C16:1)
CAR 16:1
ME472271
-
-
-
-
O-octadecenoyl-L-carnitine (acyl-C18:1)
CAR 18:1
ME472272
-
-
-
-
acyl-C18:2-OH
CAR 18:2;OH
ME472274
-
-
-
-
acetyl-carnitine (acyl-C2)
CAR 2:0
ME472258
-
-
-
-
acyl-C20:4
CAR 20:4
ME472275
-
-
-
-
propionyl-carnitine (acyl-C3)
CAR 3:0
ME472259
-
-
-
-
butanoyl-l-carnitine (acyl-C4)
CAR 4:0
ME472260
-
-
-
-
acyl-C4-OH
CAR 4:0;OH
ME472261
-
-
-
-
acyl-C5-OH
CAR 5:0;OH
ME472263
-
-
-
-
hexanoyl-L-carnitine (acyl-C6)
CAR 6:0
ME472264
-
-
-
-
L-octanoylcarnitine (acyl-C8)
CAR 8:0
ME472266
-
-
-
-
acyl-C4-DC
CAR DC4:0
ME472262
-
-
-
-
acyl-C6-DC
CAR DC6:0
ME472265
-
-
-
-
L-Carnitine
Carnitine
ME472257
-
-
-
-
Carnosine
Carnosine
ME472229
-
-
-
-
Choline
Choline
ME472256
-
-
-
-
L-Citrulline
Citrulline
ME472223
-
-
-
-
CMP
CMP
ME472195
-
-
-
-
Creatine
Creatine
ME472230
-
-
-
-
Creatinine
Creatinine
ME472231
-
-
-
-
Cys-Gly
Cys-Gly
ME472210
-
-
-
-
Cystathionine
Cystathionine
ME472216
-
-
-
-
L-cysteine
Cysteine
ME472175
-
-
-
-
Cytosine
Cytosine
ME472196
-
-
-
-
5-6-Dihydrouracil
Dihydrouracil
ME472235
-
-
-
-
Dimethylglycine
Dimethylglycine
ME472217
-
-
-
-
Ectoine
Ectoine
ME472251
-
-
-
-
L-Adrenaline
Epinephrine
ME472249
-
-
-
-
Flavin mononucleotide
FMN
ME472203
-
-
-
-
gamma-L-Glutamyl-L-cysteine
gamma-Glutamylcysteine
ME472211
-
-
-
-
(5-L-Glutamyl)-L-glutamine
gamma-Glutamylglutamine
ME472215
-
-
-
-
gamma-L-Glutamylputrescine
gamma-Glutamylputrescine
ME472214
-
-
-
-
gamma-L-Glutamyl-D-alanine
gamma-L-Glutamyl-D-alanine
ME472212
-
-
-
-
D-Glucosamine
Glucosamine
ME472228
-
-
-
-
L-glutamate
Glutamic acid
ME472176
-
-
-
-
L-glutamine
Glutamine
ME472177
-
-
-
-
Glutathione
Glutathione
ME472208
-
-
-
-
glycine
Glycine
ME472178
-
-
-
-
Guanidinoacetate
Guanidoacetic acid
ME472234
-
-
-
-
Guanine
Guanine
ME472194
-
-
-
-
Guanosine
Guanosine
ME472193
-
-
-
-
L-histidine
Histidine
ME472179
-
-
-
-
Hypotaurine
Hypotaurine
ME472238
-
-
-
-
Indole
Indole
ME472241
-
-
-
-
Indole-3-acetaldehyde
Indoleacetaldehyde
ME472242
-
-
-
-
Indole-3-acetate
Indoleacetic acid
ME472243
-
-
-
-
Indoxyl
Indoxyl
ME472244
-
-
-
-
kynurenine
Kynurenine
ME472245
-
-
-
-
L-leucine/isoleucine
Leucine/Isoleucine
ME472180
-
-
-
-
acyl-C18:2 (Linoleoyl-CoA)
Linoleoyl-CoA
ME472273
-
-
-
-
L-lysine
Lysine
ME472181
-
-
-
-
L-methionine
Methionine
ME472182
-
-
-
-
L-Methionine S-oxide
Methionine sulfoxide
ME472239
-
-
-
-
N-Acetyl-L-citrulline
N-Acetylcitrulline
ME472232
-
-
-
-
N-Acetylornithine
N-Acetylornithine
ME472233
-
-
-
-
NAD+
NAD
ME472204
-
-
-
-
NADH
NADH
ME472205
-
-
-
-
Nicotinamide
Niacinamide
ME472202
-
-
-
-
N-Methylethanolamine phosphate
N-Methylethanolamine phosphate
ME472253
-
-
-
-
Ornithine
Ornithine
ME472222
-
-
-
-
Pantetheine
Pantetheine
ME472236
-
-
-
-
Pantetheine 4--phosphate
Pantetheine 4'-phosphate
ME472237
-
-
-
-
L-phenylalanine
Phenylalanine
ME472183
-
-
-
-
Phosphoserine
Phosphoserine
ME472218
-
-
-
-
Picolinic acid
Picolinic acid
ME472247
-
-
-
-
L-proline
Proline
ME472184
-
-
-
-
Putrescine
Putrescine
ME472225
-
-
-
-
Pyridoxamine 5'-phosphate
Pyridoxamine 5'-phosphate
ME472201
-
-
-
-
5-Oxoproline
Pyroglutamic acid
ME472209
-
-
-
-
D-Rhamnose
Rhamnose
ME472206
-
-
-
-
S-Adenosyl-L-homocysteine
S-Adenosylhomocysteine
ME472219
-
-
-
-
S-Adenosyl-L-methionine
S-Adenosylmethionine
ME472220
-
-
-
-
L-serine
Serine
ME472185
-
-
-
-
Serotonin
Serotonin
ME472250
-
-
-
-
Spermidine
Spermidine
ME472226
-
-
-
-
Spermine
Spermine
ME472227
-
-
-
-
Sphingosine
Sphingosine
ME472254
-
-
-
-
Tetrahydrofolate
THF
ME472221
-
-
-
-
L-threonine
Threonine
ME472186
-
-
-
-
L-tryptophan
Tryptophan
ME472187
-
-
-
-
L-tyrosine
Tyrosine
ME472188
-
-
-
-
UDP
UDP
ME472197
-
-
-
-
Uracil
Uracil
ME472198
-
-
-
-
L-valine
Valine
ME472189
-
-
-
-
Inositol 1-2-3-5-6-pentakisphosphate
-
ME472252
-
-
-
-
O-Decenoyl-L-carnitine (acyl-C10:1)
-
ME472267
-
-
-
-
Analysis: Reversed phase NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
2-Hydroxyglutarate/Citramalate
2-Hydroxyglutaric acid
ME472318
-
-
-
-
2-Oxoglutaramate
2-Keto-glutaramic acid
ME472314
-
-
-
-
2-Oxoglutarate
2-Oxoglutaric acid
ME472313
-
-
-
-
2/3-Phospho-D-glycerate
2-Phosphoglyceric acid
ME472303
-
-
-
-
3-Sulfino-L-alanine
3-Sulfino-alanine
ME472341
-
-
-
-
3-Sulfocatechol
3-Sulfocatechol
ME472342
-
-
-
-
4-Acetamidobutanoate
4-Acetamidobutanoic acid
ME472336
-
-
-
-
4-Pyridoxate
4-Pyridoxic acid
ME472292
-
-
-
-
5-L-Glutamyl-taurine
5-L-Glutamyl-taurine
ME472328
-
-
-
-
D-Glucono-1-5-lactone 6-phosphate
6-Phosphonoglucono-D-lactone
ME472319
-
-
-
-
Adenylosuccinic acid
Adenylsuccinic acid
ME472293
-
-
-
-
ADP
ADP
ME472277
-
-
-
-
ADP-D-ribose
ADP-ribose
ME472295
-
-
-
-
Adrenic acid (7,10,13,16-Docosatetraenoic acid)
Adrenic acid
ME472369
-
-
-
-
(S)(+)-Allantoin
Allantoin
ME472287
-
-
-
-
D-Arabitol
Arabitol
ME472311
-
-
-
-
ATP
ATP
ME472276
-
-
-
-
Butanoic/Butyric acid
Butyric acid
ME472351
-
-
-
-
Decanoic acid (caprate)
Capric acid
ME472356
-
-
-
-
Hexanoic acid (caproate)
Caproic acid
ME472352
-
-
-
-
Octanoic acid (caprylate)
Caprylic acid
ME472354
-
-
-
-
Citrate
Citric acid
ME472312
-
-
-
-
CMP-N-acetylneuraminate
CMP-N-acetylneuraminic acid
ME472335
-
-
-
-
Cytidine
Cytidine
ME472279
-
-
-
-
(8Z-11Z-14Z)-Icosatrienoic acid
Dihomo-gamma-linolenic acid
ME472371
-
-
-
-
5-6-Dihydrothymine
Dihydrothymine
ME472290
-
-
-
-
Docosahexaenoic acid
Docosahexaenoic acid
ME472368
-
-
-
-
(7Z-10Z-13Z-16Z-19Z)-Docosa-7-10-13-16-19-pentaeno...
DPA
ME472372
-
-
-
-
dTMP
dTMP
ME472280
-
-
-
-
Eicosapentaenoic acid
Eicosapentaenoic acid
ME472370
-
-
-
-
Arachidonic acid (Eicosatetraenoic acid)
Eicosatetraenoic acid
ME472366
-
-
-
-
D-Erythrose 4-phosphate
Erythrose 4-phosphate
ME472320
-
-
-
-
5'-Phosphoribosyl-N-formylglycinamide
FGAR
ME472289
-
-
-
-
D-Fructose 1-6-bisphosphate
Fructose 1,6-bisphosphate
ME472301
-
-
-
-
Fumarate
Fumaric acid
ME472316
-
-
-
-
alpha-D-Glucosamine 1-phosphate
Glucosamine 1-phosphate
ME472332
-
-
-
-
D-Glucose
Glucose
ME472299
-
-
-
-
D-Glyceraldehyde 3-phosphate/Glycerone phosphate
Glyceraldehyde 3-phosphate
ME472302
-
-
-
-
GMP
GMP
ME472278
-
-
-
-
Heptanoic acid
Heptylic acid
ME472353
-
-
-
-
D-Glucose 6/1-phosphate
Hexose 6-phosphate
ME472300
-
-
-
-
Hypoxanthine
Hypoxanthine
ME472285
-
-
-
-
IMP
IMP
ME472283
-
-
-
-
Indolepyruvate
Indolepyruvate
ME472344
-
-
-
-
Inosine
Inosine
ME472284
-
-
-
-
Lactate
Lactic acid
ME472306
-
-
-
-
Dodecanoic acid (lauric acid)
Lauric acid
ME472357
-
-
-
-
Dehydroascorbate
L-Dehydroascorbic acid
ME472327
-
-
-
-
Linoleic acid ((9Z,12Z)-Octadecadienoic acid)
Linoleic acid
ME472364
-
-
-
-
Malate
Malic acid
ME472317
-
-
-
-
Maltose
Maltose
ME472307
-
-
-
-
Maltotriose
Maltotriose
ME472308
-
-
-
-
Tetradecanoic acid (myristic acid)
Myristic acid
ME472358
-
-
-
-
Tetradecenoic acid (myristoleic acid)
Myristoleic acid
ME472361
-
-
-
-
N-Acetylneuraminate
N-Acetylneuraminic acid
ME472330
-
-
-
-
NADPH
NADPH
ME472296
-
-
-
-
N-Glycoloyl-neuraminate
N-Glycoloylneuraminic acid
ME472331
-
-
-
-
a-Linolenic acid (Octadecatrienoic acid)
Octadecatrienoic acid
ME472365
-
-
-
-
Octadecenoic acid (Oleic acid)
Oleic acid
ME472363
-
-
-
-
Glutathione disulfide
Oxidized glutathione
ME472324
-
-
-
-
Hexadecanoic acid (palmitic acid)
Palmitic acid
ME472359
-
-
-
-
Hexadecenoic acid (Palmitoleic acid)
Palmitoleic acid
ME472362
-
-
-
-
Pantothenol
Pantothenol
ME472338
-
-
-
-
Nonanoic acid (pelargonate)
Pelargonic acid
ME472355
-
-
-
-
Phosphoenolpyruvate
Phosphoenolpyruvic acid
ME472304
-
-
-
-
Ethanolamine phosphate
Phosphoethanolamine
ME472349
-
-
-
-
3-Phosphonooxypyruvate
Phosphohydroxypyruvic acid
ME472329
-
-
-
-
5-Phospho-alpha-D-ribose 1-diphosphate
Phosphoribosyl pyrophosphate
ME472323
-
-
-
-
Phosphate
Phosphoric acid
ME472297
-
-
-
-
Pyridoxal
Pyridoxal
ME472291
-
-
-
-
Diphosphate
Pyrophosphate
ME472298
-
-
-
-
Pyruvate
Pyruvic acid
ME472305
-
-
-
-
quinolinic acid
Quinolinic acid
ME472345
-
-
-
-
D-4--Phosphopantothenate
(R)-4'-Phosphopantothenic acid
ME472339
-
-
-
-
D-Ribose
Ribose
ME472310
-
-
-
-
alpha-D-Ribose 1-phosphate
Ribose 1-phosphate
ME472322
-
-
-
-
S-Glutathionyl-L-cysteine
S-Glutathionyl-cysteine
ME472325
-
-
-
-
(R)-S-Lactoylglutathione
S-Lactoylglutathione
ME472343
-
-
-
-
Glycerol 3-phosphate
sn-Glycero-3-phosphate
ME472348
-
-
-
-
Mannitol/Sorbitol
Sorbitol
ME472309
-
-
-
-
Sphingosine 1-phosphate
Sphingosine 1-phosphate
ME472350
-
-
-
-
Octadecanoic acid (stearic acid)
Stearic acid
ME472360
-
-
-
-
Stearidonic acid ((6Z,9Z,12Z,15Z)-Octadecatetraeno...
Stearidonic acid
ME472367
-
-
-
-
Succinate
Succinic acid
ME472315
-
-
-
-
Taurine
Taurine
ME472340
-
-
-
-
Thymidine
Thymidine
ME472281
-
-
-
-
trans-4-Hydroxy-L-proline
trans-4-Hydroxyproline
ME472337
-
-
-
-
UDP-glucose
UDP-glucose
ME472294
-
-
-
-
UDP-N-acetyl-D-glucosamine
UDP-N-acetylglucosamine
ME472334
-
-
-
-
UMP
UMP
ME472282
-
-
-
-
Urate
Uric acid
ME472288
-
-
-
-
Ascorbate
Vitamin C
ME472326
-
-
-
-
Xanthine
Xanthine
ME472286
-
-
-
-
1-4-beta-D-Xylan
-
ME472333
-
-
-
-
1D-myo-Inositol 1-4-bisphosphate
-
ME472347
-
-
-
-
3D-(3-5/4)-Trihydroxycyclohexane-1-2-dione
-
ME472346
-
-
-
-
Sedoheptulose 1/7-phosphate
-
ME472321
-
-
-
-
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