Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:15:22 UTC
Update Date2025-03-21 18:34:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00098938
Frequency27.8
Structure
Chemical FormulaC9H12O5
Molecular Mass200.0685
SMILESCOc1cc(C(O)O)cc(OC)c1O
InChI KeyJNHXCECKYYOLSN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass methoxyphenols
Direct Parent methoxyphenols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • aromatic alcohols
  • dimethoxybenzenes
  • hydrocarbon derivatives
  • phenoxy compounds
  • Substituents
  • aromatic alcohol
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • methoxyphenol
  • alkyl aryl ether
  • methoxybenzene
  • aromatic homomonocyclic compound
  • dimethoxybenzene
  • organic oxygen compound
  • m-dimethoxybenzene
  • anisole
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound