RefMet: A Reference set of Metabolite names

(A total of 187184 compounds or isobaric mixtures as of 04/04/25)
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InChIKey: Mol. Formula: Exact mass:: +/- Daltons
Name: Super class(?): Main class(?): Sub class(?):
RefMet ID Metabolite name | MS spectra PubChem CID Super class Main class Sub class Formula Exact mass
RM0005594
1-(4-Methoxyphenyl)-1-penten-3-one
1-(4-Methoxyphenyl)-1-penten-3-one
5803450BenzenoidsPhenolsAnisolesC12H14O2190.0994
RM0058606
2,4-Dichlorobenzoic acid
2,4-Dichlorobenzoic acid
 | MS spectra		5787BenzenoidsBenzenesHydroxybenzoic acidsC7H4Cl2O2189.9588
RM0139603
2,4-Dihydroxy-2-heptenedioic acid
2,4-Dihydroxy-2-heptenedioic acid
5280910Fatty AcylsFatty acidsDicarboxylic acidsC7H10O6190.0477
RM0136793
2,6-Diaminopimelic acid
2,6-Diaminopimelic acid
99290Organic acidsAmino acids and peptidesAmino acidsC7H14N2O4190.0954
RM0158902
2-O-Methylascorbic acid
2-O-Methylascorbic acid
54726398Organoheterocyclic compoundsLactonesGamma butyrolactonesC7H10O6190.0477
RM0140085
2-Oxo-7-methylthioheptanoic acid
2-Oxo-7-methylthioheptanoic acid
22266655Fatty AcylsFatty acidsThia FAC8H14O3S190.0664
RM0037269
3,4-Dihydroxybenzenesulfonic acid
3,4-Dihydroxybenzenesulfonic acid
189003BenzenoidsBenzenesBenzenesulfonyl compoundsC6H6O5S189.9936
RM0172006
3-Carboxyadipic acid
3-Carboxyadipic acid
222467Fatty AcylsFatty acidsDicarboxylic acidsC7H10O6190.0477
RM0041606
3-Dehydroquinic acid
3-Dehydroquinic acid
439351BenzenoidsBenzenesHydroxybenzoic acidsC7H10O6190.0477
RM0137955
3-Hydroxysuberic acid
3-Hydroxysuberic acid
22328017Fatty AcylsFatty acidsDicarboxylic acidsC8H14O5190.0841
RM0058727
3-Sulfocatechol
3-Sulfocatechol
440983BenzenoidsBenzenesBenzenesulfonic acidsC6H6O5S189.9936
RM0074026
4-Hydroxy-2-oxo-heptanedioic acid
4-Hydroxy-2-oxo-heptanedioic acid
553Fatty AcylsFatty acidsDicarboxylic acidsC7H10O6190.0477
RM0029805
4-Nitroquinoline N-oxide
4-Nitroquinoline N-oxide
5955Organoheterocyclic compoundsNitroquinolinesNitroquinolinesC9H6N2O3190.0378
RM0136257
5-Methoxytryptamine
5-Methoxytryptamine
 | MS spectra		1833AlkaloidsTryptophan alkaloidsTryptaminesC11H14N2O190.1106
RM0050159
7-Ethoxycoumarin
7-Ethoxycoumarin
35703PolyketidesFlavonoidsCoumarinsC11H10O3190.0630
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