Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:45:44 UTC
Update Date2025-03-21 18:00:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00028351
Frequency132.9
Structure
Chemical FormulaC9H10O3
Molecular Mass166.063
SMILESCC(O)c1ccccc1C(=O)O
InChI KeyGPBOXVCIWMHAJH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoic acids and derivatives
Direct Parent benzoic acids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-carboxy-2-haloaromatic compounds
  • aromatic alcohols
  • benzoyl derivatives
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • carboxylic acid
  • benzoyl
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • 1-carboxy-2-haloaromatic compound
  • benzoic acid
  • organooxygen compound