RefMet: A Reference set of Metabolite names

(A total of 187184 compounds or isobaric mixtures as of 04/17/25)
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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
RM0135946
3-(3-Hydroxyphenyl)propanoic acid
3-(3-Hydroxyphenyl)propanoic acid
91Organic acidsPhenylpropanoidsCinnamic acidsC9H10O3166.0630
RM0030044
3-(2-Hydroxyphenyl)propanoic acid
3-(2-Hydroxyphenyl)propanoic acid
873Organic acidsPhenylpropanoidsCinnamic acidsC9H10O3166.0630
RM0040270
Phthalic acid
Phthalic acid
 | MS spectra		1017BenzenoidsBenzenesHydroxybenzoic acidsC8H6O4166.0266
RM0039835
Perillic acid
Perillic acid
1256Prenol LipidsIsoprenoidsC10 isoprenoidsC10H14O2166.0994
RM0037541
Apocynin
Apocynin
2214BenzenoidsBenzenesHydroxybenzoic acidsC9H10O3166.0630
RM0150696
1-Deoxy-D-glucitol
1-Deoxy-D-glucitol
3429Fatty AcylsFatty alcoholsFatty alcoholsC6H14O5166.0841
RM0157057
6-Methylthiopurine
6-Methylthiopurine
5778Nucleic acidsPurinesThiopurinesC6H6N4S166.0313
RM0021843
Fluorene
Fluorene
 | MS spectra		6853PolyketidesAromatic polyketidesAnthracenes and phenanthrenesC13H10166.0782
RM0029779
3,4-Methylenedioxybenzoic acid
3,4-Methylenedioxybenzoic acid
7196BenzenoidsBenzenesHydroxybenzoic acidsC8H6O4166.0266
RM0159624
Terephthalic acid
Terephthalic acid
7489BenzenoidsBenzenesHydroxybenzoic acidsC8H6O4166.0266
RM0040269
4-Methoxyphenylacetic acid
4-Methoxyphenylacetic acid
7690Organic acidsPhenylpropanoidsCinnamic acidsC9H10O3166.0630
RM0188937
Ethyl salicylate
Ethyl salicylate
8365BenzenoidsBenzenesHydroxybenzoic acid estersC9H10O3166.0630
RM0188946
3,4-Dimethoxybenzaldehyde
3,4-Dimethoxybenzaldehyde
8419BenzenoidsPhenolsMethoxyphenolsC9H10O3166.0630
RM0028098
Ethylparaben
Ethylparaben
 | MS spectra		8434BenzenoidsBenzenesHydroxybenzoic acidsC9H10O3166.0630
RM0050309
Desaminotyrosine
Desaminotyrosine
10394Organic acidsPhenylpropanoidsCinnamic acidsC9H10O3166.0630
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