Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:37:01 UTC
Update Date2025-03-21 17:57:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00008512
Frequency575.1
Structure
Chemical FormulaC10H12O4
Molecular Mass196.0736
SMILESCOc1cc(C=O)cc(OC)c1OC
InChI KeyOPHQOIGEOHXOGX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass anisoles
Direct Parent anisoles
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • benzaldehydes
  • benzoyl derivatives
  • hydrocarbon derivatives
  • methoxybenzenes
  • organic oxides
  • phenoxy compounds
  • Substituents
  • monocyclic benzene moiety
  • ether
  • benzoyl
  • aldehyde
  • alkyl aryl ether
  • methoxybenzene
  • aromatic homomonocyclic compound
  • benzaldehyde
  • organic oxide
  • aryl-aldehyde
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound