Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:14 UTC
Update Date2025-03-21 18:35:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00106000
Frequency25.4
Structure
Chemical FormulaC10H12O3
Molecular Mass180.0786
SMILESCOc1ccc(CC(=O)CO)cc1
InChI KeyDBOUWPKVWGWIGO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass anisoles
Direct Parent anisoles
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkyl aryl ethers
  • alpha-hydroxy ketones
  • hydrocarbon derivatives
  • methoxybenzenes
  • organic oxides
  • phenoxy compounds
  • Substituents
  • alcohol
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • alkyl aryl ether
  • alpha-hydroxy ketone
  • methoxybenzene
  • ketone
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound