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Return to study ST002058 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
2-Aminomuconate
2-Aminomuconic acid
ME475001
-
-
-
-
3-4-Dihydroxy-L-phenylalanine
-
ME475048
-
-
-
-
3',5'-Cyclic IMP
3',5' cyclic IMP
ME474958
-
-
-
-
3alpha-12alpha-Dihydroxy-5beta-cholanate
Deoxycholic acid
ME475052
-
-
-
-
3D-(3-5/4)-Trihydroxycyclohexane-1-2-dione
-
ME475005
-
-
-
-
4-Coumarate
cis-p-Coumaric acid
ME475051
-
-
-
-
4-Hydroxyphenylacetylglutamic acid
4-Hydroxyphenylacetylglutamine
ME475050
-
-
-
-
4-Imidazolone-5-propanoate
4-Imidazolone-5-propionic acid
ME475059
-
-
-
-
5-6-Dihydrouracil
Dihydrouracil
ME474994
-
-
-
-
5-Hydroxyisourate
5-Hydroxyisouric acid
ME474955
-
-
-
-
(5-L-Glutamyl)-L-glutamine
gamma-Glutamylglutamine
ME474975
-
-
-
-
5-Methylthioadenosine
5'-Methylthioadenosine
ME474983
-
-
-
-
5-Oxoproline
Pyroglutamic acid
ME474967
-
-
-
-
Acetylcarnitine
CAR 2:0
ME475012
-
-
-
-
Adenine
Adenine
ME474938
-
-
-
-
Adenosine
Adenosine
ME474937
-
-
-
-
Adenylyl sulfate
Adenosine phosphosulfate
ME474959
-
-
-
-
Allantoate
Allantoic acid
ME474957
-
-
-
-
Alpha-linolenyl carnitine
-
ME475041
-
-
-
-
AMP
AMP
ME474935
-
-
-
-
Argininosuccinate
Argininosuccinic acid
ME474982
-
-
-
-
Ascorbate
Vitamin C
ME474970
-
-
-
-
Asymmetric dimethyl arginine
Dimethylarginine
ME474989
-
-
-
-
Atherospermidine
Atherospermidine
ME474988
-
-
-
-
Biliverdin
Biliverdin
ME475057
-
-
-
-
Butyrylcarnitine
CAR 4:0
ME475015
-
-
-
-
Carnosine
Carnosine
ME474990
-
-
-
-
CDP-choline
CDP-choline
ME475010
-
-
-
-
Cervonyl carnitine
CAR 22:6
ME475045
-
-
-
-
CMP
CMP
ME474942
-
-
-
-
Cys-Gly
Cys-Gly
ME474969
-
-
-
-
Cytidine
Cytidine
ME474943
-
-
-
-
Cytosine
Cytosine
ME474944
-
-
-
-
dAMP
dAMP
ME474936
-
-
-
-
Decanoylcarnitine
CAR 10:0
ME475028
-
-
-
-
Dehydroascorbate
Dehydroascorbic acid
ME474971
-
-
-
-
Diethanolamine
Diethanolamine
ME475007
-
-
-
-
Docosapentaenoyl carnitine
CAR 22:5
ME475046
-
-
-
-
Dodecanedioylcarnitine
CAR DC12:0
ME475036
-
-
-
-
Dodecenoylcarnitine
CAR 12:1
ME475031
-
-
-
-
Ectoine
Ectoine
ME475004
-
-
-
-
Elaidic carnitine
CAR 18:1(9E)
ME475043
-
-
-
-
gamma-Glutamyl-gamma-aminobutyrate
4-(Glutamylamino) butanoate
ME474973
-
-
-
-
gamma-L-Glutamyl-D-alanine
gamma-L-Glutamyl-D-alanine
ME474972
-
-
-
-
gamma-L-Glutamylputrescine
gamma-Glutamylputrescine
ME474974
-
-
-
-
Glutathione
Glutathione
ME474965
-
-
-
-
Glutathione disulfide
Oxidized glutathione
ME474966
-
-
-
-
glycine
Glycine
ME474922
-
-
-
-
GMP
GMP
ME474939
-
-
-
-
g-Oxalo-crotonate
4-Oxalocrotonic acid
ME475000
-
-
-
-
Guanidinoacetate
Guanidoacetic acid
ME474992
-
-
-
-
Guanine
Guanine
ME474941
-
-
-
-
Guanosine
Guanosine
ME474940
-
-
-
-
Heptadecanoyl carnitine
CAR 17:0
ME475039
-
-
-
-
Hexadecadienoylcarnitine
CAR 16:2
ME475047
-
-
-
-
Hexadecenoyl carnitine
CAR 16:0
ME475037
-
-
-
-
Hexanoylcarnitine
CAR 6:0
ME475020
-
-
-
-
Hexenoylcarnitine
CAR 6:1
ME475019
-
-
-
-
Hydroxydecanoyl carnitine
CAR 10:0;OH
ME475030
-
-
-
-
Hydroxydodecanoyl carnitine
CAR 12:0;OH
ME475033
-
-
-
-
Hydroxyhexadecanoyl carnitine
CAR 16:0;OH
ME475040
-
-
-
-
Hydroxyhexadecenoylcarnitine
CAR 16:1;OH
ME475038
-
-
-
-
Hydroxyisovaleroyl carnitine
CAR 4:0;OH,Me
ME475022
-
-
-
-
Hydroxynonanoyl carnitine
CAR 9:0;OH
ME475029
-
-
-
-
Hydroxyoctadecenoylcarnitine
CAR 18:1;OH
ME475044
-
-
-
-
Hydroxyoctanoyl carnitine
CAR 8:0;OH
ME475027
-
-
-
-
Hydroxyundecanoyl carnitine
CAR 10:0;OH
ME475032
-
-
-
-
Hypotaurine
Hypotaurine
ME474996
-
-
-
-
Hypoxanthine
Hypoxanthine
ME474951
-
-
-
-
IMP
IMP
ME474949
-
-
-
-
Inosine
Inosine
ME474950
-
-
-
-
Isovalerylcarnitine
CAR 4:0;3Me
ME475017
-
-
-
-
Kynurenine
Kynurenine
ME474998
-
-
-
-
L-Adrenaline
Epinephrine
ME475002
-
-
-
-
L-alanine
Alanine
ME474915
-
-
-
-
L-arginine
Arginine
ME474916
-
-
-
-
L-asparagine
Asparagine
ME474917
-
-
-
-
L-aspartate
Aspartic acid
ME474918
-
-
-
-
L-Carnitine
Carnitine
ME475011
-
-
-
-
L-Citrulline
Citrulline
ME474981
-
-
-
-
L-cysteine
Cysteine
ME474919
-
-
-
-
L-cystine
Cystine
ME474934
-
-
-
-
Leukotriene C4
LTC4
ME475053
-
-
-
-
L-glutamate
Glutamic acid
ME474920
-
-
-
-
L-glutamine
Glutamine
ME474921
-
-
-
-
L-histidine
Histidine
ME474923
-
-
-
-
L-Homocysteine
Homocysteine
ME474976
-
-
-
-
Linoelaidyl carnitine
CAR 18:2(9E,12E)
ME475042
-
-
-
-
L-leucine
Leucine
ME474924
-
-
-
-
L-lysine
Lysine
ME474925
-
-
-
-
L-methionine
Methionine
ME474926
-
-
-
-
L-Methionine S-oxide
Methionine sulfoxide
ME474997
-
-
-
-
L-phenylalanine
Phenylalanine
ME474927
-
-
-
-
L-proline
Proline
ME474928
-
-
-
-
L-serine
Serine
ME474929
-
-
-
-
L-threonine
Threonine
ME474930
-
-
-
-
L-tryptophan
Tryptophan
ME474931
-
-
-
-
L-tyrosine
Tyrosine
ME474932
-
-
-
-
L-valine
Valine
ME474933
-
-
-
-
Malonylcarnitine
CAR DC3:0
ME475018
-
-
-
-
Methylglutarylcarnitine
CAR DC5:0;3Me
ME475025
-
-
-
-
Methylmalonylcarnitine
CAR DC3:0;2Me
ME475021
-
-
-
-
Mevalonate
Mevalonic acid
ME475055
-
-
-
-
N1-Acetylspermidine
N1-Acetylspermidine
ME474987
-
-
-
-
N-Acetyl-D-phenylalanine
N-Acetylphenylalanine
ME475061
-
-
-
-
N-Acetyl-L-aspartate
N-Acetylaspartic acid
ME475062
-
-
-
-
N-Acetyl-L-glutamate
N-Acetylglutamic acid
ME475063
-
-
-
-
N-Acetyl-L-histidine
N-Acetylhistidine
ME475064
-
-
-
-
N-Acetylmethionine
N-Acetylmethionine
ME475060
-
-
-
-
NADH
NADH
ME474964
-
-
-
-
NADPH
NADPH
ME474963
-
-
-
-
N-formyl kynurenine
N-Formyl-L-kynurenine
ME474999
-
-
-
-
Nicotinamide
Niacinamide
ME474961
-
-
-
-
Nicotinate ribonucleotide
Nicotinic acid mononucleotide
ME474962
-
-
-
-
N-Methylethanolamine phosphate
N-Methylethanolamine phosphate
ME475009
-
-
-
-
Octanoylcarnitine
CAR 8:0
ME475024
-
-
-
-
Octenoylcarnitine
CAR 8:1
ME475023
-
-
-
-
Ornithine
Ornithine
ME474980
-
-
-
-
Phosphocreatine
Phosphocreatine
ME474991
-
-
-
-
Phosphoserine
Phosphoserine
ME474977
-
-
-
-
Pimelylcarnitine
CAR DC7:0
ME475026
-
-
-
-
Propenoylcarnitine
CAR 3:1
ME475013
-
-
-
-
Propionylcarnitine
CAR 3:0
ME475014
-
-
-
-
Putrescine
Putrescine
ME474984
-
-
-
-
Pyridoxal
Pyridoxal
ME474960
-
-
-
-
S-Adenosyl-L-homocysteine
S-Adenosylhomocysteine
ME474978
-
-
-
-
S-Adenosyl-L-methionine
S-Adenosylmethionine
ME474979
-
-
-
-
(S)(+)-Allantoin
Allantoin
ME474956
-
-
-
-
Serotonin
Serotonin
ME475003
-
-
-
-
S-Glutathionyl-L-cysteine
S-Glutathionyl-cysteine
ME474968
-
-
-
-
sn-glycero-3-Phosphoethanolamine
sn-Glycero-3-phosphoethanolamine
ME475006
-
-
-
-
Spermidine
Spermidine
ME474985
-
-
-
-
Spermine
Spermine
ME474986
-
-
-
-
Sphingosine
Sphingosine
ME475056
-
-
-
-
Taurine
Taurine
ME474995
-
-
-
-
Testosterone
Testosterone
ME475054
-
-
-
-
Tetradecanoylcarnitine
CAR 14:0
ME475035
-
-
-
-
Tetradecenoylcarnitine
CAR 14:1
ME475034
-
-
-
-
Thymidine
Thymidine
ME474945
-
-
-
-
Thymine
Thymine
ME474946
-
-
-
-
Tiglylcarnitine
CAR 4:1;2Me
ME475016
-
-
-
-
trans-4-Hydroxy-L-proline
trans-4-Hydroxyproline
ME474993
-
-
-
-
Triethanolamine
Triethanolamine
ME475008
-
-
-
-
trimethylamineoxide
Trimethylamine N-oxide
ME475058
-
-
-
-
Tyramine
Tyramine
ME475049
-
-
-
-
UMP
UMP
ME474947
-
-
-
-
Uracil
Uracil
ME474948
-
-
-
-
Urate
Uric acid
ME474954
-
-
-
-
Xanthine
Xanthine
ME474953
-
-
-
-
Xanthosine
Xanthosine
ME474952
-
-
-
-
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
ME475093
-
-
-
-
2',3'-Cyclic CMP
2',3' cyclic CMP
ME475076
-
-
-
-
2/3-Phospho-D-glycerate
2-Phosphoglyceric acid
ME475094
-
-
-
-
2-Hydroxyglutarate
2-Hydroxyglutaric acid
ME475112
-
-
-
-
2-Oxoglutaramate
2-Keto-glutaramic acid
ME475107
-
-
-
-
2-Oxoglutarate
2-Oxoglutaric acid
ME475106
-
-
-
-
3',5'-Cyclic AMP
3',5' cyclic AMP
ME475075
-
-
-
-
3-Fumarylpyruvate
-
ME475175
-
-
-
-
3-Hydroxyisobutyrate
3-Hydroxyisobutyric acid
ME475124
-
-
-
-
3-Methyldioxyindole
3-Methyldioxyindole
ME475140
-
-
-
-
3-Phosphonooxypyruvate
Phosphohydroxypyruvic acid
ME475122
-
-
-
-
4-Hydroxyphenylacetate
4-Hydroxyphenyl acetate
ME475174
-
-
-
-
5-Hydroxyindoleacetate
5-Hydroxyindoleacetic acid
ME475139
-
-
-
-
5-L-Glutamyl-taurine
5-L-Glutamyl-taurine
ME475120
-
-
-
-
5'-Phosphoribosyl-N-formylglycinamide
FGAR
ME475077
-
-
-
-
6-Phospho-D-gluconate
6-Phosphogluconic acid
ME475115
-
-
-
-
(7Z-10Z-13Z-16Z-19Z)-Docosa-7-10-13-16-19-pentaeno...
DPA
ME475169
-
-
-
-
(8Z-11Z-14Z)-Icosatrienoic acid
Dihomo-gamma-linolenic acid
ME475168
-
-
-
-
Acetoacetate
Acetoacetic acid
ME475150
-
-
-
-
Acetylcholine
Acetylcholine
ME475149
-
-
-
-
Adenylosuccinic acid
Adenylsuccinic acid
ME475079
-
-
-
-
ADP
ADP
ME475066
-
-
-
-
ADP-D-ribose
ADP-ribose
ME475081
-
-
-
-
alhpa-tocopheronolactone
Alhpa-tocopheronolactone
ME475170
-
-
-
-
alpha-D-Glucosamine 1-phosphate
Glucosamine 1-phosphate
ME475127
-
-
-
-
Anthranilate
2-Aminobenzoic acid
ME475143
-
-
-
-
ATP
ATP
ME475065
-
-
-
-
Carbamoyl phosphate
Carbamoylphosphate
ME475123
-
-
-
-
CDP
CDP
ME475070
-
-
-
-
CDP-ethanolamine
CDP-Ethanolamine
ME475146
-
-
-
-
CerP
-
ME475176
-
-
-
-
Cholesterol sulfate
Cholesterol sulfate
ME475187
-
-
-
-
cis-Aconitate
cis-Aconitic acid
ME475104
-
-
-
-
Citrate
Citric acid
ME475105
-
-
-
-
CMP-N-acetylneuraminate
CMP-N-acetylneuraminic acid
ME475132
-
-
-
-
Creatine
Creatine
ME475134
-
-
-
-
Creatinine
Creatinine
ME475135
-
-
-
-
CTP
CTP
ME475069
-
-
-
-
D-Arabitol/Xylitol/Ribitol
-
ME475103
-
-
-
-
Decanoic acid
Capric acid
ME475155
-
-
-
-
D-Erythrose 4-phosphate
Erythrose 4-phosphate
ME475116
-
-
-
-
D-Fructose 1-6-bisphosphate
Fructose 1,6-bisphosphate
ME475091
-
-
-
-
D-Glucono-1-5-lactone 6-phosphate
6-Phosphonoglucono-D-lactone
ME475114
-
-
-
-
D-Glucoronate
-
ME475128
-
-
-
-
D-Glucose
Glucose
ME475089
-
-
-
-
D-Glyceraldehyde 3-phosphate/Glycerone phosphate
Glyceraldehyde 3-phosphate
ME475092
-
-
-
-
D-Hexose-phosphate
-
ME475090
-
-
-
-
dihydroxy-octadecanoic acid
-
ME475171
-
-
-
-
Dimethylglycine
Dimethylglycine
ME475121
-
-
-
-
Diphosphate
Pyrophosphate
ME475088
-
-
-
-
Docosahexaenoic acid
Docosahexaenoic acid
ME475167
-
-
-
-
Dodecanoic acid
Lauric acid
ME475156
-
-
-
-
D-Rhamnose
Rhamnose
ME475102
-
-
-
-
D-Ribose
Ribose
ME475101
-
-
-
-
Eicosapentaenoic acid
Eicosapentaenoic acid
ME475166
-
-
-
-
Eicosatetraenoic acid
Eicosatetraenoic acid
ME475165
-
-
-
-
FAD
FAD
ME475083
-
-
-
-
FADH2
FADH2
ME475084
-
-
-
-
Flavin mononucleotide
FMN
ME475082
-
-
-
-
Fumarate
Fumaric acid
ME475109
-
-
-
-
gamma-L-Glutamyl-L-cysteine
gamma-Glutamylcysteine
ME475119
-
-
-
-
GDP
GDP
ME475068
-
-
-
-
Glycerol 3-phosphate
sn-Glycero-3-phosphate
ME475144
-
-
-
-
GTP
GTP
ME475067
-
-
-
-
HETE
HETE
ME475180
-
-
-
-
Hexadecanoic acid
Palmitic acid
ME475158
-
-
-
-
Hexadecenoic acid
Hexadecenoic acid
ME475161
-
-
-
-
Hexanoic acid
Caproic acid
ME475152
-
-
-
-
HODE
HODE
ME475179
-
-
-
-
Homocarnosine
Homocarnosine
ME475133
-
-
-
-
Homovanillate
Homovanillic acid
ME475173
-
-
-
-
IDP
IDP
ME475074
-
-
-
-
Indole-5-6-quinone
-
ME475172
-
-
-
-
Itaconate
Itaconic acid
ME475113
-
-
-
-
ITP
ITP
ME475073
-
-
-
-
Kynurenic acid
Kynurenic acid
ME475141
-
-
-
-
Lactate
Lactic acid
ME475097
-
-
-
-
Leukotriene A4
LTA4
ME475186
-
-
-
-
Malate
Malic acid
ME475110
-
-
-
-
Maltose/Sucrose
-
ME475098
-
-
-
-
Maltotriose
Maltotriose
ME475099
-
-
-
-
Mannitol/Sorbitol/Glucitol/Iditol
-
ME475100
-
-
-
-
Mevalonate-P
5-Phosphomevalonic acid
ME475188
-
-
-
-
Mevalonate-PP
-
ME475189
-
-
-
-
N-acetyl-D-glucosamine
N-Acetylglucosamine
ME475131
-
-
-
-
N-Acetyl-L-leucine
N-Acetylleucine
ME475192
-
-
-
-
N-Acetylneuraminate
N-Acetylneuraminic acid
ME475125
-
-
-
-
NAD+
NAD
ME475086
-
-
-
-
NADP+
NADP
ME475085
-
-
-
-
N-Glycoloyl-neuraminate
N-Glycoloylneuraminic acid
ME475126
-
-
-
-
Nonanoic acid
Pelargonic acid
ME475154
-
-
-
-
Octadecadienoic acid
Octadecadienoic acid
ME475163
-
-
-
-
Octadecanoic acid
Stearic acid
ME475159
-
-
-
-
Octadecatrienoic acid
Octadecatrienoic acid
ME475164
-
-
-
-
Octadecenoic acid
Octadecenoic acid
ME475162
-
-
-
-
Octanoic acid
Caprylic acid
ME475153
-
-
-
-
Oxaloacetate
Oxaloacetic acid
ME475111
-
-
-
-
Pantetheine
Pantetheine
ME475138
-
-
-
-
Pantetheine 4--phosphate
Pantetheine 4'-phosphate
ME475137
-
-
-
-
Pantothenate
Pantothenic acid
ME475136
-
-
-
-
Pentanoate
Valeric acid
ME475151
-
-
-
-
Pentose phosphates (isobars)
Ribulose 5-phosphate
ME475118
-
-
-
-
Phosphate
Phosphoric acid
ME475087
-
-
-
-
Phosphodimethyl-ethanolamine
N,N-Dimethylethanolamine phosphate
ME475147
-
-
-
-
Phosphoenolpyruvate
Phosphoenolpyruvic acid
ME475095
-
-
-
-
Phosphoethanolamine
Phosphoethanolamine
ME475145
-
-
-
-
Prostaglandin A2/B2
-
ME475181
-
-
-
-
Prostaglandin D2/Thromboxane A2 (isobars)
-
ME475182
-
-
-
-
Prostaglandin F2alpha/beta/D1 (isobars)
-
ME475183
-
-
-
-
Prostaglandin G2
PGG2
ME475184
-
-
-
-
Pyridoxamine 5'-phosphate
Pyridoxamine 5'-phosphate
ME475078
-
-
-
-
Pyruvate
Pyruvic acid
ME475096
-
-
-
-
Quinolinic acid
Quinolinic acid
ME475142
-
-
-
-
Sedoheptulose 7-phosphate
Sedoheptulose 7-phosphate
ME475117
-
-
-
-
Serine-Phosphoethanolamine
-
ME475148
-
-
-
-
Sphinganine 1-phosphate
Sphinganine 1-phosphate
ME475191
-
-
-
-
Sphingosine 1-phosphate
Sphingosine 1-phosphate
ME475190
-
-
-
-
Succinate
Succinic acid
ME475108
-
-
-
-
Taurochenodeoxycholate/Tauroursodeoxycholate
-
ME475178
-
-
-
-
Taurocholate
Taurocholic acid
ME475177
-
-
-
-
Tetradecanoic acid
Myristic acid
ME475157
-
-
-
-
Tetradecenoic acid
Tetradecenoic acid
ME475160
-
-
-
-
Thromboxane B2
TXB2
ME475185
-
-
-
-
UDP
UDP
ME475072
-
-
-
-
UDP-D-glucuronate
UDP-glucuronic acid
ME475129
-
-
-
-
UDP-glucose
UDP-glucose
ME475080
-
-
-
-
UDP-N-acetyl-D-glucosamine
UDP-N-acetylglucosamine
ME475130
-
-
-
-
UTP
UTP
ME475071
-
-
-
-
UCSD Metabolomics Workbench, a resource sponsored by the Common Fund of the National Institutes of Health
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