Record Information |
---|
HMDB Status | predicted |
---|
Creation Date | 2024-02-20 23:34:45 UTC |
---|
Update Date | 2025-03-21 17:56:44 UTC |
---|
HMDB ID | HMDB0141265 |
---|
Metabolite Identification |
---|
DeepMet ID | DMID00003254 |
---|
Name | 3-(3-methoxyphenyl)-2-oxopropanoic acid |
---|
Frequency | 1808.8 |
---|
Structure | |
---|
Chemical Formula | C10H10O4 |
---|
Molecular Mass | 194.0579 |
---|
SMILES | COc1cccc(CC(=O)C(=O)O)c1 |
---|
InChI Key | QRICSZPYENRNSS-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | benzenoids |
---|
Class | benzene and substituted derivatives |
---|
Subclass | phenylpyruvic acid derivatives |
---|
Direct Parent | phenylpyruvic acid derivatives |
---|
Geometric Descriptor | aromatic homomonocyclic compounds |
---|
Alternative Parents | alkyl aryl ethersalpha-hydroxy ketonesalpha-keto acids and derivativesanisolescarboxylic acidshydrocarbon derivativesmethoxybenzenesmonocarboxylic acids and derivativesorganic oxidesphenoxy compoundsphenylpropanoic acids |
---|
Substituents | phenol ethercarbonyl groupethercarboxylic acidphenylpyruvate3-phenylpropanoic-acidalkyl aryl etheralpha-hydroxy ketonecarboxylic acid derivativemethoxybenzeneketonearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundanisoleketo acidalpha-keto acidhydrocarbon derivativephenoxy compoundorganooxygen compound |
---|