Record Information |
---|
HMDB Status | expected |
---|
Creation Date | 2024-02-20 23:41:33 UTC |
---|
Update Date | 2025-03-21 17:59:06 UTC |
---|
HMDB ID | HMDB0002222 |
---|
Metabolite Identification |
---|
DeepMet ID | DMID00018787 |
---|
Name | 3-Methylphenylacetic acid |
---|
Frequency | 219.5 |
---|
Structure | |
---|
Chemical Formula | C9H10O2 |
---|
Molecular Mass | 150.0681 |
---|
SMILES | Cc1cccc(CC(=O)O)c1 |
---|
InChI Key | GJMPSRSMBJLKKB-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | benzenoids |
---|
Class | benzene and substituted derivatives |
---|
Subclass | toluenes |
---|
Direct Parent | toluenes |
---|
Geometric Descriptor | aromatic homomonocyclic compounds |
---|
Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
---|
Substituents | carbonyl groupcarboxylic acidcarboxylic acid derivativearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativetolueneorganooxygen compound |
---|