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Return to study ST002039 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
5-Guanidino-2-oxopentanoate
2-Oxoarginine
ME472612
-
-
-
-
gamma-Glutamyl-gamma-aminobutyrate
4-(Glutamylamino) butanoate
ME472602
-
-
-
-
5-Hydroxyindoleacetate
5-Hydroxyindoleacetic acid
ME472620
-
-
-
-
5-Hydroxyisourate
5-Hydroxyisouric acid
ME472590
-
-
-
-
6-Hydroxykynurenic acid
6-Hydroxykynurenic acid
ME472626
-
-
-
-
6-Phospho-D-gluconate
6-Phosphogluconic acid
ME472598
-
-
-
-
Acetylcholine
Acetylcholine
ME472631
-
-
-
-
Adenosine
Adenosine
ME472581
-
-
-
-
ADP-D-ribose
ADP-ribose
ME472594
-
-
-
-
L-alanine
Alanine
ME472562
-
-
-
-
Allantoate
Allantoic acid
ME472589
-
-
-
-
L-arginine
Arginine
ME472563
-
-
-
-
L-asparagine
Asparagine
ME472564
-
-
-
-
L-aspartate
Aspartic acid
ME472565
-
-
-
-
O-dodecanoyl-carnitine (acyl-C12)
CAR 12:0
ME472643
-
-
-
-
O-dodecenoyl-carnitine (acyl-C12:1)
CAR 12:1
ME472644
-
-
-
-
O-tetradecanoyl-L-carnitine (acyl-C14)
CAR 14:0
ME472645
-
-
-
-
Tetradecenoyl Carnitine (acyl-C14:1)
CAR 14:1
ME472646
-
-
-
-
L-Palmitoylcarnitine (acyl-C16)
CAR 16:0
ME472647
-
-
-
-
Hexadecenoyl-carnitine (acyl-C16:1)
CAR 16:1
ME472648
-
-
-
-
Octadecanoyl-L-carnitine (acyl-C18)
CAR 18:0
ME472649
-
-
-
-
O-octadecenoyl-L-carnitine (acyl-C18:1)
CAR 18:1
ME472650
-
-
-
-
acetyl-carnitine (acyl-C2)
CAR 2:0
ME472634
-
-
-
-
acyl-C20:4
CAR 20:4
ME472652
-
-
-
-
propionyl-carnitine (acyl-C3)
CAR 3:0
ME472635
-
-
-
-
butanoyl-l-carnitine (acyl-C4)
CAR 4:0
ME472636
-
-
-
-
acyl-C4-OH
CAR 4:0;OH
ME472637
-
-
-
-
acyl-C5-OH
CAR 5:0;OH
ME472639
-
-
-
-
hexanoyl-L-carnitine (acyl-C6)
CAR 6:0
ME472640
-
-
-
-
L-octanoylcarnitine (acyl-C8)
CAR 8:0
ME472641
-
-
-
-
acyl-C4-DC
CAR DC4:0
ME472638
-
-
-
-
L-Carnitine
Carnitine
ME472633
-
-
-
-
Carnosine
Carnosine
ME472611
-
-
-
-
Choline
Choline
ME472632
-
-
-
-
L-Citrulline
Citrulline
ME472608
-
-
-
-
Creatinine
Creatinine
ME472613
-
-
-
-
Cys-Gly
Cys-Gly
ME472600
-
-
-
-
L-cysteine
Cysteine
ME472566
-
-
-
-
Cytidine
Cytidine
ME472584
-
-
-
-
Cytosine
Cytosine
ME472585
-
-
-
-
5-6-Dihydrouracil
Dihydrouracil
ME472617
-
-
-
-
Dimethylglycine
Dimethylglycine
ME472604
-
-
-
-
L-Adrenaline
Epinephrine
ME472628
-
-
-
-
5'-Phosphoribosyl-N-formylglycinamide
FGAR
ME472591
-
-
-
-
Flavin mononucleotide
FMN
ME472595
-
-
-
-
gamma-L-Glutamyl-L-cysteine
gamma-Glutamylcysteine
ME472601
-
-
-
-
gamma-L-Glutamylputrescine
gamma-Glutamylputrescine
ME472603
-
-
-
-
L-glutamate
Glutamic acid
ME472567
-
-
-
-
L-glutamine
Glutamine
ME472568
-
-
-
-
Glutathione
Glutathione
ME472599
-
-
-
-
glycine
Glycine
ME472569
-
-
-
-
Guanidinoacetate
Guanidoacetic acid
ME472615
-
-
-
-
Guanine
Guanine
ME472583
-
-
-
-
Guanosine
Guanosine
ME472582
-
-
-
-
L-histidine
Histidine
ME472570
-
-
-
-
Hypoxanthine
Hypoxanthine
ME472587
-
-
-
-
Indole
Indole
ME472621
-
-
-
-
Indole-3-acetaldehyde
Indoleacetaldehyde
ME472622
-
-
-
-
Indole-3-acetate
Indoleacetic acid
ME472623
-
-
-
-
Indolepyruvate
Indolepyruvate
ME472624
-
-
-
-
Indoxyl
Indoxyl
ME472625
-
-
-
-
Inosine
Inosine
ME472586
-
-
-
-
L-leucine/isoleucine
Leucine/Isoleucine
ME472571
-
-
-
-
acyl-C18:2 (Linoleoyl-CoA)
Linoleoyl-CoA
ME472651
-
-
-
-
L-lysine
Lysine
ME472572
-
-
-
-
L-methionine
Methionine
ME472573
-
-
-
-
N-Acetylornithine
N-Acetylornithine
ME472614
-
-
-
-
NAD+
NAD
ME472597
-
-
-
-
NADP+
NADP
ME472596
-
-
-
-
Nicotinamide
Niacinamide
ME472593
-
-
-
-
Pantetheine
Pantetheine
ME472618
-
-
-
-
Pantetheine 4--phosphate
Pantetheine 4'-phosphate
ME472619
-
-
-
-
Pantothenol
Pantothenol
ME472616
-
-
-
-
L-phenylalanine
Phenylalanine
ME472574
-
-
-
-
Phosphoserine
Phosphoserine
ME472605
-
-
-
-
Picolinic acid
Picolinic acid
ME472627
-
-
-
-
L-proline
Proline
ME472575
-
-
-
-
Pyridoxamine 5'-phosphate
Pyridoxamine 5'-phosphate
ME472592
-
-
-
-
S-Adenosyl-L-homocysteine
S-Adenosylhomocysteine
ME472606
-
-
-
-
S-Adenosyl-L-methionine
S-Adenosylmethionine
ME472607
-
-
-
-
L-serine
Serine
ME472576
-
-
-
-
Serotonin
Serotonin
ME472629
-
-
-
-
Spermidine
Spermidine
ME472609
-
-
-
-
Spermine
Spermine
ME472610
-
-
-
-
Sphingosine
Sphingosine
ME472630
-
-
-
-
L-threonine
Threonine
ME472577
-
-
-
-
L-tryptophan
Tryptophan
ME472578
-
-
-
-
L-tyrosine
Tyrosine
ME472579
-
-
-
-
L-valine
Valine
ME472580
-
-
-
-
Xanthine
Xanthine
ME472588
-
-
-
-
O-Decenoyl-L-carnitine (acyl-C10:1)
-
ME472642
-
-
-
-
Analysis: Reversed phase NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
Anthranilate
2-Aminobenzoic acid
ME472725
-
-
-
-
2-Hydroxyglutarate/Citramalate
2-Hydroxyglutaric acid
ME472697
-
-
-
-
2-Oxoglutarate
2-Oxoglutaric acid
ME472693
-
-
-
-
2/3-Phospho-D-glycerate
2-Phosphoglyceric acid
ME472684
-
-
-
-
3',5'-Cyclic AMP
3',5' cyclic AMP
ME472671
-
-
-
-
1/2-3-Bisphosphoglycerate
3-Phospho-D-glyceroyl dihydrogen phosphate
ME472683
-
-
-
-
3-Sulfino-L-alanine
3-Sulfino-alanine
ME472723
-
-
-
-
g-Oxalo-crotonate
4-Oxalocrotonic acid
ME472726
-
-
-
-
4-Pyridoxate
4-Pyridoxic acid
ME472674
-
-
-
-
5-L-Glutamyl-taurine
5-L-Glutamyl-taurine
ME472708
-
-
-
-
Adenine
Adenine
ME472656
-
-
-
-
Adenylosuccinic acid
Adenylsuccinic acid
ME472675
-
-
-
-
ADP
ADP
ME472654
-
-
-
-
Adrenic acid (7,10,13,16-Docosatetraenoic acid)
Adrenic acid
ME472751
-
-
-
-
(S)(+)-Allantoin
Allantoin
ME472669
-
-
-
-
AMP
AMP
ME472655
-
-
-
-
D-Arabitol
Arabitol
ME472691
-
-
-
-
Argininosuccinate
Argininosuccinic acid
ME472712
-
-
-
-
ATP
ATP
ME472653
-
-
-
-
Butanoic/Butyric acid
Butyric acid
ME472732
-
-
-
-
Decanoic acid (caprate)
Capric acid
ME472738
-
-
-
-
Hexanoic acid (caproate)
Caproic acid
ME472734
-
-
-
-
Octanoic acid (caprylate)
Caprylic acid
ME472736
-
-
-
-
CDP
CDP
ME472660
-
-
-
-
Citrate
Citric acid
ME472692
-
-
-
-
CMP
CMP
ME472661
-
-
-
-
CMP-N-acetylneuraminate
CMP-N-acetylneuraminic acid
ME472717
-
-
-
-
Cystathionine
Cystathionine
ME472709
-
-
-
-
Dehydroascorbate
Dehydroascorbic acid
ME472705
-
-
-
-
(8Z-11Z-14Z)-Icosatrienoic acid
Dihomo-gamma-linolenic acid
ME472753
-
-
-
-
5-6-Dihydrothymine
Dihydrothymine
ME472672
-
-
-
-
Docosahexaenoic acid
Docosahexaenoic acid
ME472750
-
-
-
-
(7Z-10Z-13Z-16Z-19Z)-Docosa-7-10-13-16-19-pentaeno...
DPA
ME472754
-
-
-
-
Eicosapentaenoic acid
Eicosapentaenoic acid
ME472752
-
-
-
-
Arachidonic acid (Eicosatetraenoic acid)
Eicosatetraenoic acid
ME472748
-
-
-
-
D-Erythrose 4-phosphate
Erythrose 4-phosphate
ME472698
-
-
-
-
D-Fructose 1-6-bisphosphate
Fructose 1,6-bisphosphate
ME472681
-
-
-
-
Fumarate
Fumaric acid
ME472695
-
-
-
-
(5-L-Glutamyl)-L-glutamine
gamma-Glutamylglutamine
ME472707
-
-
-
-
gamma-L-Glutamyl-D-alanine
gamma-L-Glutamyl-D-alanine
ME472706
-
-
-
-
GDP
GDP
ME472658
-
-
-
-
alpha-D-Glucosamine 1-phosphate
Glucosamine 1-phosphate
ME472714
-
-
-
-
D-Glucose
Glucose
ME472679
-
-
-
-
D-Glyceraldehyde 3-phosphate/Glycerone phosphate
Glyceraldehyde 3-phosphate
ME472682
-
-
-
-
Glycolate
Glycolic acid
ME472718
-
-
-
-
GMP
GMP
ME472659
-
-
-
-
GTP
GTP
ME472657
-
-
-
-
Heptanoic acid
Heptylic acid
ME472735
-
-
-
-
D-Glucose 6/1-phosphate
Hexose 6-phosphate
ME472680
-
-
-
-
Homocarnosine
Homocarnosine
ME472719
-
-
-
-
IMP
IMP
ME472668
-
-
-
-
Lactate
Lactic acid
ME472687
-
-
-
-
Dodecanoic acid (lauric acid)
Lauric acid
ME472739
-
-
-
-
Linoleic acid ((9Z,12Z)-Octadecadienoic acid)
Linoleic acid
ME472746
-
-
-
-
Malate
Malic acid
ME472696
-
-
-
-
Tetradecanoic acid (myristic acid)
Myristic acid
ME472740
-
-
-
-
Tetradecenoic acid (myristoleic acid)
Myristoleic acid
ME472743
-
-
-
-
N-Acetylneuraminate
N-Acetylneuraminic acid
ME472713
-
-
-
-
a-Linolenic acid (Octadecatrienoic acid)
Octadecatrienoic acid
ME472747
-
-
-
-
Octadecenoic acid (Oleic acid)
Oleic acid
ME472745
-
-
-
-
Ornithine
Ornithine
ME472711
-
-
-
-
Glutathione disulfide
Oxidized glutathione
ME472701
-
-
-
-
Hexadecanoic acid (palmitic acid)
Palmitic acid
ME472741
-
-
-
-
Hexadecenoic acid (Palmitoleic acid)
Palmitoleic acid
ME472744
-
-
-
-
Nonanoic acid (pelargonate)
Pelargonic acid
ME472737
-
-
-
-
Phosphocreatine
Phosphocreatine
ME472720
-
-
-
-
Phosphoenolpyruvate
Phosphoenolpyruvic acid
ME472685
-
-
-
-
Ethanolamine phosphate
Phosphoethanolamine
ME472729
-
-
-
-
3-Phosphonooxypyruvate
Phosphohydroxypyruvic acid
ME472710
-
-
-
-
Phosphate
Phosphoric acid
ME472677
-
-
-
-
Pyridoxal
Pyridoxal
ME472673
-
-
-
-
5-Oxoproline
Pyroglutamic acid
ME472702
-
-
-
-
Diphosphate
Pyrophosphate
ME472678
-
-
-
-
Pyruvate
Pyruvic acid
ME472686
-
-
-
-
quinolinic acid
Quinolinic acid
ME472724
-
-
-
-
D-Rhamnose
Rhamnose
ME472690
-
-
-
-
D-Ribose
Ribose
ME472689
-
-
-
-
alpha-D-Ribose 1-phosphate
Ribose 1-phosphate
ME472700
-
-
-
-
S-Glutathionyl-L-cysteine
S-Glutathionyl-cysteine
ME472703
-
-
-
-
Glycerol 3-phosphate
sn-Glycero-3-phosphate
ME472728
-
-
-
-
Mannitol/Sorbitol
Sorbitol
ME472688
-
-
-
-
Sphinganine 1-phosphate
Sphinganine 1-phosphate
ME472731
-
-
-
-
Sphingosine 1-phosphate
Sphingosine 1-phosphate
ME472730
-
-
-
-
Octadecanoic acid (stearic acid)
Stearic acid
ME472742
-
-
-
-
Stearidonic acid ((6Z,9Z,12Z,15Z)-Octadecatetraeno...
Stearidonic acid
ME472749
-
-
-
-
Succinate
Succinic acid
ME472694
-
-
-
-
Taurine
Taurine
ME472722
-
-
-
-
Thymidine
Thymidine
ME472662
-
-
-
-
Thymine
Thymine
ME472663
-
-
-
-
trans-4-Hydroxy-L-proline
trans-4-Hydroxyproline
ME472721
-
-
-
-
UDP
UDP
ME472665
-
-
-
-
UDP-glucose
UDP-glucose
ME472676
-
-
-
-
UDP-N-acetyl-D-glucosamine
UDP-N-acetylglucosamine
ME472716
-
-
-
-
UMP
UMP
ME472666
-
-
-
-
Uracil
Uracil
ME472667
-
-
-
-
Urate
Uric acid
ME472670
-
-
-
-
UTP
UTP
ME472664
-
-
-
-
Pentanoate (valerate)
Valeric acid
ME472733
-
-
-
-
Ascorbate
Vitamin C
ME472704
-
-
-
-
1-4-beta-D-Xylan
-
ME472715
-
-
-
-
3D-(3-5/4)-Trihydroxycyclohexane-1-2-dione
-
ME472727
-
-
-
-
Sedoheptulose 1/7-phosphate
-
ME472699
-
-
-
-
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