Record Information |
---|
HMDB Status | Not Available |
---|
Creation Date | 2024-02-20 23:33:47 UTC |
---|
Update Date | 2025-03-21 17:56:22 UTC |
---|
HMDB ID | Not Available |
---|
Metabolite Identification |
---|
DeepMet ID | DMID00000965 |
---|
Frequency | 5921.2 |
---|
Structure | |
---|
Chemical Formula | C8H8O4 |
---|
Molecular Mass | 168.0423 |
---|
SMILES | O=C(O)Cc1ccc(O)cc1O |
---|
InChI Key | FSQDURCMBCGCIK-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | benzenoids |
---|
Class | benzene and substituted derivatives |
---|
Subclass | phenylacetic acids |
---|
Direct Parent | 2(hydroxyphenyl)acetic acids |
---|
Geometric Descriptor | aromatic homomonocyclic compounds |
---|
Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsbenzene and substituted derivativescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesresorcinols |
---|
Substituents | carbonyl groupcarboxylic acid1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidcarboxylic acid derivativeresorcinolaromatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundphenolhydrocarbon derivativeorganooxygen compound2(hydroxyphenyl)acetic acid |
---|