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Return to study ST001441 main page
Analysis: HILIC POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
12S-HHT
12S-HHTrE
ME327630
-
-
-
-
1-methylnicotinamide
1-Methyl nicotinamide
ME327604
-
-
-
-
1-methylpyrrolinium
1-Methylpyrrolinium
ME327733
-
-
-
-
anthranilate
2-Aminobenzoic acid
ME327605
-
-
-
-
4-Imidazolone-5-propanoate
4-Imidazolone-5-propionic acid
ME327599
-
-
-
-
5-Hydroxyindoleacetate
5-Hydroxyindoleacetic acid
ME327618
-
-
-
-
5-methoxytryptophol
5-Methoxytryptophol
ME327623
-
-
-
-
5-Methylthioadenosine
5'-Methylthioadenosine
ME327625
-
-
-
-
acetamidopropanal
Acetamidopropanal
ME327648
-
-
-
-
adenine
Adenine
ME327703
-
-
-
-
adenosine
Adenosine
ME327701
-
-
-
-
L-Alanyl-L-leucine
Ala-Leu
ME327614
-
-
-
-
L-alanine
Alanine
ME327699
-
-
-
-
L-asparagine
Asparagine
ME327684
-
-
-
-
benzoate
Benzoic acid
ME327602
-
-
-
-
beta-carboline
beta-Carboline
ME327622
-
-
-
-
glycine betaine
Betaine
ME327696
-
-
-
-
Biotin
Biotin
ME327690
-
-
-
-
decanoyl carnitine
CAR 10:0
ME327719
-
-
-
-
decenoyl carnitine
CAR 10:1
ME327718
-
-
-
-
lauroyl carnitine
CAR 12:0
ME327732
-
-
-
-
3-hydroxyhexadecenoylcarnitine
CAR 12:1;OH
ME327723
-
-
-
-
tetradecanoyl carnitine(myristoyl carnitine)
CAR 14:0
ME327727
-
-
-
-
tetradecenoyl carnitine
CAR 14:1
ME327720
-
-
-
-
L-palmitoylcarnitine
CAR 16:0
ME327722
-
-
-
-
3-hydroxyhexadecanoylcarnitine
CAR 16:0;3OH
ME327724
-
-
-
-
trans-Hexadec-2-enoyl carnitine
CAR 16:1(2E)
ME327728
-
-
-
-
heptadecanoyl carnitine
CAR 17:0
ME327725
-
-
-
-
stearoylcarnitine
CAR 18:0
ME327726
-
-
-
-
Linoleyl carnitine/Linoelaidyl carnitine
CAR 18:2
ME327730
-
-
-
-
alpha-linolenyl carnitine/gamma-linolenyl carnitin...
CAR 18:3
ME327729
-
-
-
-
O-acetylcarnitine
CAR 2:0
ME327708
-
-
-
-
propionyl-carnitine
CAR 3:0
ME327709
-
-
-
-
butyryl carnitine
CAR 4:0
ME327710
-
-
-
-
3-Hydroxybutyrylcarnitine
CAR 4:0;3OH
ME327711
-
-
-
-
3-hydroxy-isovaleryl carnitine
CAR 4:0;OH,Me
ME327714
-
-
-
-
tiglyl carnitine
CAR 4:1;2Me
ME327713
-
-
-
-
octanoyl carnitine/L-Octanoylcarnitine
CAR 8:0
ME327717
-
-
-
-
octenoyl carnitine
CAR 8:1
ME327716
-
-
-
-
succinyl carnitine
CAR DC4:0
ME327712
-
-
-
-
glutaryl carnitine
CAR DC5:0
ME327715
-
-
-
-
(R)-carnitine
Carnitine
ME327707
-
-
-
-
CDPcholine
CDP-choline
ME327635
-
-
-
-
CDP-ethanolamine
CDP-Ethanolamine
ME327632
-
-
-
-
choline
Choline
ME327686
-
-
-
-
choline phosphate
Choline phosphate
ME327595
-
-
-
-
CMP-N-trimethyl-2-aminoethylphosphonate
CMP-2-trimethylaminoethylphosphonate
ME327634
-
-
-
-
coumarin
Coumarin
ME327612
-
-
-
-
creatine
Creatine
ME327590
-
-
-
-
creatinine
Creatinine
ME327589
-
-
-
-
L-cysteinylglycine
Cys-Gly
ME327594
-
-
-
-
L-cysteine
Cysteine
ME327682
-
-
-
-
cytosine
Cytosine
ME327705
-
-
-
-
D-Alanyl-D-alanine
D-Alanyl-D-Alanine
ME327600
-
-
-
-
2-deoxycytidine
Deoxycytidine
ME327702
-
-
-
-
5,6-dihydrothymine
Dihydrothymine
ME327592
-
-
-
-
NN-dimethylglycine
Dimethylglycine
ME327683
-
-
-
-
Flavin adenine dinucleotide oxidized
FAD
ME327643
-
-
-
-
Folate
Folic acid
ME327694
-
-
-
-
L-glutamine
Glutamine
ME327697
-
-
-
-
glutathione
Glutathione
ME327621
-
-
-
-
glycine
Glycine
ME327734
-
-
-
-
Glycylleucine
Gly-Leu
ME327658
-
-
-
-
Guanine
Guanine
ME327704
-
-
-
-
histamine
Histamine
ME327647
-
-
-
-
L-histidine
Histidine
ME327688
-
-
-
-
L-homocysteine
Homocysteine
ME327685
-
-
-
-
methyl indole-3-acetate
Indole-3-methyl acetate
ME327667
-
-
-
-
L-kynurenine
Kynurenine
ME327666
-
-
-
-
L-methionine
Methionine
ME327687
-
-
-
-
Methionine sulfoxide
Methionine sulfoxide
ME327737
-
-
-
-
Methylimidazoleacetic acid
Methylimidazoleacetic acid
ME327598
-
-
-
-
(R)-mevalonate
Mevalonic acid
ME327652
-
-
-
-
N6N6N6-Trimethyl-L-lysine
N-6-Trimethyllysine
ME327613
-
-
-
-
N-Acetylmethionine
N-Acetylmethionine
ME327656
-
-
-
-
N-acetylneuraminic acid
N-Acetylneuraminic acid
ME327626
-
-
-
-
N(2)-acetyl-L-ornithine
N-Acetylornithine
ME327606
-
-
-
-
NAD+
NAD+
ME327639
-
-
-
-
NADP+
NADP+
ME327640
-
-
-
-
naphthalene
Naphthalene
ME327616
-
-
-
-
Nicotinamide
Niacinamide
ME327596
-
-
-
-
N-Methylethanolamine phosphate
N-Methylethanolamine phosphate
ME327588
-
-
-
-
Phosphodimethylethanolamine
N,N-Dimethylethanolamine phosphate
ME327591
-
-
-
-
Ornithine
Ornithine
ME327649
-
-
-
-
GSSG
Oxidized glutathione
ME327637
-
-
-
-
perillyl aldehyde
Perillyl aldehyde
ME327617
-
-
-
-
phenylacetaldehyde
Phenylacetaldehyde
ME327680
-
-
-
-
L-phenylalanine
Phenylalanine
ME327689
-
-
-
-
2-phenylethanamine
Phenylethylamine
ME327607
-
-
-
-
L-proline
Proline
ME327700
-
-
-
-
Pyridoxal
Pyridoxal
ME327609
-
-
-
-
Riboflavin
Riboflavin
ME327693
-
-
-
-
S-(2-Methylpropanoyl)-dihydrolipoamide
S-(2-Methylpropionyl)-dihydrolipoamide-E
ME327629
-
-
-
-
S-Adenosyl-L-homocysteine
S-Adenosylhomocysteine
ME327691
-
-
-
-
S-adenosyl-L-methionine
S-Adenosylmethionine
ME327692
-
-
-
-
sarcosine
Sarcosine
ME327735
-
-
-
-
L-serine
Serine
ME327681
-
-
-
-
sn-Glycero-3-phosphocholine
sn-Glycero-3-phosphocholine
ME327610
-
-
-
-
thiamine
Thiamine
ME327628
-
-
-
-
L-threonine
Threonine
ME327695
-
-
-
-
Trimethylamine N-oxide
Trimethylamine N-oxide
ME327736
-
-
-
-
L-tyrosine
Tyrosine
ME327698
-
-
-
-
Urocanate
Urocanic acid
ME327597
-
-
-
-
xanthosine
Xanthosine
ME327620
-
-
-
-
13-carboxy-gama-tocopherol
-
ME327644
-
-
-
-
24-oxo-1alpha-23-25-trihydroxyvitamin D3
-
ME327642
-
-
-
-
25-hydroxyvitamin D3-26-23-lactone
-
ME327641
-
-
-
-
2-keto-4-methylthiobutyrate
-
ME327593
-
-
-
-
3,5-dihydroxy-3,4-dihydro-1,4-benzothiazine
-
ME327624
-
-
-
-
3-Hydroxy-N6N6N6-trimethyl-L-lysine
-
ME327615
-
-
-
-
3-oxo-10(R)-hydroxy-octadeca-6E8E12Z-trienoate/3-o...
-
ME327669
-
-
-
-
3(S)10(R)-OH-octadeca-6-trans-412-cis-trienoate
-
ME327631
-
-
-
-
3-Ureidoisobutyrate/Glycylsarcosine
-
ME327650
-
-
-
-
4-trimethylammoniobutanal
-
ME327603
-
-
-
-
5-amino-1-(5-phospho-D-ribosyl)imidazole
-
ME327611
-
-
-
-
5beta-cholestane-3alpha-7alpha-12alpha-25-tetrol/5...
-
ME327678
-
-
-
-
5-guanidino-2-oxopentanoic acid
-
ME327679
-
-
-
-
5-S-glutathionyl-dopamine
-
ME327636
-
-
-
-
acetylcholine/4-(trimethylammonio)butanoate
-
ME327653
-
-
-
-
Adrenaline/L-Normetanephrine
-
ME327661
-
-
-
-
beta-1-4-mannose-N-acetylglucosamine
-
ME327633
-
-
-
-
C18H32O4(3)
-
ME327670
-
-
-
-
C20H28O2(7)
-
ME327673
-
-
-
-
C20H28O(5)
-
ME327671
-
-
-
-
C20H30O(4)
-
ME327672
-
-
-
-
C27H42O4(3)
-
ME327677
-
-
-
-
C27H44O2(5)
-
ME327674
-
-
-
-
C27H44O3(5)
-
ME327676
-
-
-
-
C27H46O2(5)
-
ME327675
-
-
-
-
C4H9NO2(4)
-
ME327645
-
-
-
-
C6H11NO3(4)
-
ME327651
-
-
-
-
C9H8O3(3)
-
ME327660
-
-
-
-
citr_L[e]
-
ME327601
-
-
-
-
CMP-N-acetyl-beta-neuraminate
-
ME327638
-
-
-
-
dopaminochrome
-
ME327608
-
-
-
-
Elaidic carnitine/Vaccenyl carnitine
-
ME327731
-
-
-
-
gama-L-glutamyl-L-alanine/5-L-Glutamyl-L-alanine-1
-
ME327659
-
-
-
-
Glycylproline/L-Prolinylglycine
-
ME327655
-
-
-
-
indole-3-acetate/(5-hydroxyindol-3-yl)acetaldehyde
-
ME327664
-
-
-
-
isoputreanine/putreanine
-
ME327654
-
-
-
-
limonene/(+)-alpha-pinene
-
ME327663
-
-
-
-
NeuNGc
-
ME327627
-
-
-
-
N-methyl-467-trihydroxy-1234-tetrahydroisoquinolin...
-
ME327619
-
-
-
-
pendtadenoyl carnitine
-
ME327721
-
-
-
-
pseudoecgonine/ecgonine
-
ME327662
-
-
-
-
Pyridoxine/Norepinephrine-1
-
ME327657
-
-
-
-
(-)-Salsolinol/NN-dimethyldopaminequinone-1
-
ME327665
-
-
-
-
sphingosine/3-dehydrosphinganine
-
ME327668
-
-
-
-
thymine/imidazol-4-ylacetate
-
ME327706
-
-
-
-
Ureidopropionic acid/Glycyl-glycine
-
ME327646
-
-
-
-
Analysis: HILIC NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
w-hydroxydecanoicacid
10-Hydroxydecanoic acid
ME327789
-
-
-
-
omega hydroxy dodecanoate (n-C12:0)
12-Hydroxy lauric acid
ME327796
-
-
-
-
2-aminomuconate
2-Aminomuconic acid
ME327759
-
-
-
-
2-Hydroxyglutarate
2-Hydroxyglutaric acid
ME327926
-
-
-
-
2-methylglutaconic acid
2-Methylglutaconic acid
ME327756
-
-
-
-
2-oxoglutarate
2-Oxoglutaric acid
ME327921
-
-
-
-
3-Deoxy-D-glycero-D-galacto-2-nonulosonic acid
3-Deoxy-D-glycero-D-galacto-2-nonulosonic acid
ME327784
-
-
-
-
3-hydroxyanthranilate
3-Hydroxyanthranilic acid
ME327766
-
-
-
-
(S)-dihydroorotate
4,5-Dihydroorotic acid
ME327750
-
-
-
-
4-pyridoxate
4-Pyridoxic acid
ME327772
-
-
-
-
5-Hydroxyisourate
5-Hydroxyisouric acid
ME327753
-
-
-
-
5-Methoxyindoleacetate
5-Methoxyindoleacetic acid
ME327793
-
-
-
-
6-Phosphogluconic acid
6-Phosphogluconic acid
ME327764
-
-
-
-
acetoacetate
Acetoacetic acid
ME327925
-
-
-
-
adipic acid
Adipic acid
ME327757
-
-
-
-
ADP
ADP
ME327895
-
-
-
-
ADP-ribose
ADP-ribose
ME327821
-
-
-
-
allantoate
Allantoic acid
ME327744
-
-
-
-
L-2-aminoadipate
alpha-Aminoadipic acid
ME327845
-
-
-
-
AMP
AMP
ME327894
-
-
-
-
arachidonic acid
Arachidonic acid
ME327866
-
-
-
-
arginine
Arginine
ME327761
-
-
-
-
aspartate
Aspartic acid
ME327889
-
-
-
-
ATP
ATP
ME327896
-
-
-
-
Azelaic acid
Azelaic acid
ME327777
-
-
-
-
caprate
Capric acid
ME327788
-
-
-
-
N-Carbamoyl-L-aspartate
Carbamoylaspartate
ME327752
-
-
-
-
carnosine
Carnosine
ME327779
-
-
-
-
CDP
CDP
ME327898
-
-
-
-
cholesterol sulfate
Cholesterol sulfate
ME327832
-
-
-
-
cis-aconitate
cis-Aconitic acid
ME327920
-
-
-
-
citrate/isocitrate
Citric acid/Isocitric acid
ME327919
-
-
-
-
CMP
CMP
ME327897
-
-
-
-
CTP
CTP
ME327899
-
-
-
-
L-cystathionine
Cystathionine
ME327770
-
-
-
-
L-cysteate
Cysteic acid
ME327884
-
-
-
-
cytidine
Cytidine
ME327906
-
-
-
-
Deoxyinosine
Deoxyinosine
ME327909
-
-
-
-
Deoxyuridine
Deoxyuridine
ME327910
-
-
-
-
docosahexaenoate(DHA)
DHA
ME327873
-
-
-
-
8,11,14-Eicosatrienoic acid (DGLA)
Dihomo-gamma-linolenic acid
ME327814
-
-
-
-
Dihydroxyacetone phosphate
Dihydroxyacetone phosphate
ME327914
-
-
-
-
docosanedioicacid
Docosanedioic acid
ME327826
-
-
-
-
Dodecanedioic acid
Dodecanedioic acid
ME327797
-
-
-
-
dTTP
dTTP
ME327929
-
-
-
-
dUDP
dUDP
ME327903
-
-
-
-
dUMP
dUMP
ME327928
-
-
-
-
Eicosenoic acid
Eicosenoic acid
ME327815
-
-
-
-
D-Erythrose 4-phosphate
Erythrose 4-phosphate
ME327745
-
-
-
-
L-erythrulose
Erythrulose
ME327742
-
-
-
-
estrone 3-sulfate
Estrone 3-sulfate
ME327813
-
-
-
-
N-Formimidoyl-L-glutamate
Formiminoglutamic acid
ME327847
-
-
-
-
beta-D-Fructose 1,6-bisphosphate
Fructose 1,6-bisphosphate
ME327913
-
-
-
-
fructosyllysine
Fructosyllysine
ME327798
-
-
-
-
fumarate
Fumaric acid
ME327923
-
-
-
-
Galactosylglycerol
Galactosylglycerol
ME327781
-
-
-
-
GDP
GDP
ME327892
-
-
-
-
D-Glucosamine 6-phosphate
Glucosamine 6-phosphate
ME327763
-
-
-
-
alpha-D-glucose
Glucose
ME327911
-
-
-
-
G6P/F6P
Glucose 6-phosphate
ME327912
-
-
-
-
L-glutamate
Glutamic acid
ME327886
-
-
-
-
D-glycerate
Glyceric acid
ME327834
-
-
-
-
glycochenodeoxycholate
Glycochenodeoxycholic acid
ME327829
-
-
-
-
glycolithocholate
Glycolithocholic acid
ME327828
-
-
-
-
Glycyl-phenylalanine
Gly-Phe
ME327794
-
-
-
-
GMP
GMP
ME327891
-
-
-
-
GTP
GTP
ME327893
-
-
-
-
guanosine
Guanosine
ME327905
-
-
-
-
gulonate
Gulonic acid
ME327853
-
-
-
-
Hexadecanedioic acid
Hexadecanedioic acid
ME327809
-
-
-
-
Hypotaurine
Hypotaurine
ME327738
-
-
-
-
Hypoxanthine
Hypoxanthine
ME327890
-
-
-
-
inosine
Inosine
ME327904
-
-
-
-
omega hydroxy hexadecanoate (n-C16:0)
Juniperic acid
ME327807
-
-
-
-
3-methyl-2-oxobutanoate
Ketoisovaleric acid
ME327747
-
-
-
-
kynurenate
Kynurenic acid
ME327790
-
-
-
-
lactate
Lactic acid
ME327918
-
-
-
-
laurate
Lauric acid
ME327795
-
-
-
-
L-isoleucine/L-leucine
Leucine/Isoleucine
ME327881
-
-
-
-
lithocholate
Lithocholic acid
ME327827
-
-
-
-
lysine
Lysine
ME327758
-
-
-
-
malate
Malic acid
ME327924
-
-
-
-
margarate
Margaric acid
ME327810
-
-
-
-
myo-inositol
Myo-inositol
ME327887
-
-
-
-
myristate
Myristic acid
ME327800
-
-
-
-
N-acetyl-L-glutamate
N-Acetylglutamic acid
ME327769
-
-
-
-
NADH
NADH
ME327824
-
-
-
-
NADPH
NADPH
ME327825
-
-
-
-
oleic acid/elaidate/trans-vaccenate
Octadecenoic acid
ME327861
-
-
-
-
2-oxoadipate
Oxoadipic acid
ME327760
-
-
-
-
palmitate
Palmitic acid
ME327806
-
-
-
-
palmitoleate
Palmitoleic acid
ME327805
-
-
-
-
(R)-Pantothenate
Pantothenic acid
ME327778
-
-
-
-
nonanoate
Pelargonic acid
ME327774
-
-
-
-
pentadecanoate
Pentadecylic acid
ME327804
-
-
-
-
Perillic acid
Perillic acid
ME327786
-
-
-
-
Phosphoenolpyruvate
Phosphoenolpyruvic acid
ME327916
-
-
-
-
O-Phospho-L-serine
Phosphoserine
ME327741
-
-
-
-
pristanic acid
Pristanic acid
ME327864
-
-
-
-
Diphosphate
Pyrophosphate
ME327883
-
-
-
-
pyruvate
Pyruvic acid
ME327917
-
-
-
-
quinolinate
Quinolinic acid
ME327767
-
-
-
-
ribose-phosphate
Ribose 5-phosphate
ME327843
-
-
-
-
Sedoheptulose 7-phosphate
Sedoheptulose 7-phosphate
ME327771
-
-
-
-
Glycerol 3-phosphate
sn-Glycero-3-phosphate
ME327740
-
-
-
-
stearate
Stearic acid
ME327811
-
-
-
-
succinate(2-)
Succinic acid
ME327922
-
-
-
-
sulfoglycolithocholate
Sulfoglycolithocholic acid
ME327831
-
-
-
-
Taurine
Taurine
ME327739
-
-
-
-
taurolithocholate
Taurolithocholic acid
ME327830
-
-
-
-
tetradecenoate (n-C14:1)
Tetradecenoic acid
ME327799
-
-
-
-
L-threonate
Threonic acid
ME327743
-
-
-
-
Thymidine
Thymidine
ME327908
-
-
-
-
L-tryptophan
Tryptophan
ME327792
-
-
-
-
UDP
UDP
ME327901
-
-
-
-
UDP-alpha-D-xylose
UDP-D-xylose
ME327820
-
-
-
-
UDP-D-glucuronate
UDP-glucuronic acid
ME327822
-
-
-
-
UMP
UMP
ME327900
-
-
-
-
uracil
Uracil
ME327888
-
-
-
-
uridine
Uridine
ME327907
-
-
-
-
UTP
UTP
ME327902
-
-
-
-
Valine
Valine
ME327927
-
-
-
-
Xanthine
Xanthine
ME327749
-
-
-
-
11'-Carboxy-alpha-chromanol
-
ME327808
-
-
-
-
12,13-epoxy-9-hydroperoxy-10E-octadecenoate
-
ME327812
-
-
-
-
13-carboxy-alpha-tocopherol
-
ME327833
-
-
-
-
15(S)-Hydroxyeicosatrienoic acid
-
ME327816
-
-
-
-
2-acetamido-5-oxopentanoate
-
ME327768
-
-
-
-
2-deoxy-D-ribose 5-phosphate/2-Deoxy-D-ribose 1-ph...
-
ME327842
-
-
-
-
2-keto-3-deoxy-D-glycero-D-galactononic acid 9-pho...
-
ME327785
-
-
-
-
3alpha-7alpha-12alpha-Trihydroxy-5beta-cholestanoa...
-
ME327880
-
-
-
-
3-dehydro-L-gulonate/D-glucuronate/L-iduronate
-
ME327852
-
-
-
-
3-Keto-beta-D-galactose/L-Gulonolactone
-
ME327849
-
-
-
-
3-methyl-2-oxopentanoate/4-methyl-2-oxopentanoate(...
-
ME327844
-
-
-
-
3(S)6(R)-dihydroxy-tetradec-8Z-enoate/3(S)6(S)-dih...
-
ME327803
-
-
-
-
4,6-Dihydroxyquinoline/quinoline-4,8-diol
-
ME327858
-
-
-
-
4-hydroperoxy-2-nonenal
-
ME327776
-
-
-
-
4-hydroxy-2-nonenal/3,4-epoxynonanal
-
ME327857
-
-
-
-
(4-hydroxy-3-methoxyphenyl)acetaldehyde
-
ME327775
-
-
-
-
4-hydroxybenzoate/Gentisate aldehyde
-
ME327765
-
-
-
-
4-Hydroxyphenylacetate/2-Hydroxyphenylacetate/3,4-...
-
ME327856
-
-
-
-
4-nitrophenolate
-
ME327755
-
-
-
-
4(R)-hydroxy-dodec-6Z-enoate/4(S)-hydroxy-dodec-6Z...
-
ME327859
-
-
-
-
5-oxoproline/L-1-Pyrroline-3-hydroxy-5-carboxylate
-
ME327836
-
-
-
-
6(S)-hydroxy-tetradeca-2E4E8Z-trienoate/6(R)-hydro...
-
ME327801
-
-
-
-
7,9-dihydro-1H-purine-2688(3H)-trione
-
ME327751
-
-
-
-
9(10)-EpOME/12(13)-EpOME
-
ME327862
-
-
-
-
9,10-hydroxyoctadec-12(Z)-enoate/12,13-hydroxyocta...
-
ME327863
-
-
-
-
ADP-mannose/GDP-L-fucose/ADP alpha-D-glucoside
-
ME327876
-
-
-
-
beta-hydroxy-beta-methylbutyrate
-
ME327748
-
-
-
-
C20H30O2(4)
-
ME327865
-
-
-
-
C20H30O3(6)
-
ME327868
-
-
-
-
C20H30O4(18)
-
ME327870
-
-
-
-
C20H32O3(12)
-
ME327869
-
-
-
-
C20H32O4(21)
-
ME327871
-
-
-
-
C20H34O4(4)
-
ME327872
-
-
-
-
C27H46O4(3)
-
ME327879
-
-
-
-
C4H8O3(3)
-
ME327835
-
-
-
-
C5H10O5(6)
-
ME327839
-
-
-
-
C6H12O6(5)
-
ME327850
-
-
-
-
clupanodonic acid/docosa-4,7,10,13,16-pentaenoic a...
-
ME327874
-
-
-
-
D-Glucuronate 1-phosphate
-
ME327885
-
-
-
-
D-Glycerate 3-phosphate/D-Glycerate 2-phosphate
-
ME327915
-
-
-
-
fructoseglycine
-
ME327773
-
-
-
-
fructoselysine 3-phosphate
-
ME327818
-
-
-
-
gama-L-glutamyl-L-alpha-aminobutyrate
-
ME327780
-
-
-
-
GDP-D-mannose
-
ME327823
-
-
-
-
itaconate/Mesaconate
-
ME327837
-
-
-
-
L-4-hydroxyglutamate semialdehyde
-
ME327838
-
-
-
-
L-arabinitol/xylitol/D-ribitol
-
ME327840
-
-
-
-
L-fucose/L-Fuculose
-
ME327846
-
-
-
-
L-Iditol/D-glucitol/galactitol
-
ME327851
-
-
-
-
linoleic acid/linoelaidic acid (all trans C18:2)/o...
-
ME327860
-
-
-
-
L-xylonate/L-lyxonate
-
ME327841
-
-
-
-
Methylisocitric acid/2-methylcitrate
-
ME327854
-
-
-
-
N-acetyl-L-aspartate/2-Amino-3-oxoadipate
-
ME327848
-
-
-
-
N-Acetylneuraminate 9-phosphate
-
ME327817
-
-
-
-
N-acetyl-seryl-aspartate
-
ME327783
-
-
-
-
N(omega)-(L-Arginino)succinate
-
ME327791
-
-
-
-
N-phosphocreatinate
-
ME327746
-
-
-
-
omega hydroxy tetradecanoate (n-C14:0)
-
ME327802
-
-
-
-
oxalatosuccinate
-
ME327762
-
-
-
-
phenylacetate/(4-hydroxyphenyl)acetaldehyde
-
ME327855
-
-
-
-
phytanic acid/arachidic acid
-
ME327867
-
-
-
-
(R)-2-hydroxy-4-methylpentanoate
-
ME327754
-
-
-
-
(R)-S-lactoylglutathionate
-
ME327819
-
-
-
-
S-[2-carboxy-1-(1 H-imidazol-4-yl)ethyl]-L-cystein...
-
ME327782
-
-
-
-
Taurodeoxycholic acid/taurochenodeoxycholate
-
ME327878
-
-
-
-
thiosulfate
-
ME327882
-
-
-
-
trans-4,5-epoxy-2(E)-decenal
-
ME327787
-
-
-
-
UDP-D-glucose/UDP-D-galactose
-
ME327875
-
-
-
-
UDP-N-acetyl-alpha-D-glucosamine/UDP-N-acetyl-alph...
-
ME327877
-
-
-
-
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-methyltetrahydrofolate
5-Methyl-THF
ME327930
-
-
-
-
acetyl-CoA
Acetyl-CoA
ME327932
-
-
-
-
Coenzyme A
Coenzyme A
ME327931
-
-
-
-
Hydroxymethylglutaryl-CoA
Hydroxymethylglutaryl-CoA
ME327936
-
-
-
-
malonyl-CoA
Malonyl-CoA
ME327934
-
-
-
-
propionyl-CoA
Propionyl-CoA
ME327933
-
-
-
-
Succinyl-CoA
Succinyl-CoA
ME327935
-
-
-
-
UCSD Metabolomics Workbench, a resource sponsored by the Common Fund of the National Institutes of Health
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