Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:54:51 UTC
Update Date2025-03-21 18:04:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00050174
Frequency65.5
Structure
Chemical FormulaC11H14O4
Molecular Mass210.0892
SMILESCCOc1ccc(CC(=O)O)cc1OC
InChI KeyXVNXRPVJRCYHEW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass anisoles
Direct Parent anisoles
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • methoxybenzenes
  • monocarboxylic acids and derivatives
  • organic oxides
  • phenoxy compounds
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • carboxylic acid
  • alkyl aryl ether
  • carboxylic acid derivative
  • methoxybenzene
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound