Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:49 UTC
Update Date2025-03-25 00:48:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02171156
Frequency0.5
Structure
Chemical FormulaC9H10O4
Molecular Mass182.0579
SMILESCOc1c(O)ccc(CO)c1C=O
InChI KeyRBISUTXIGNHKRJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass methoxyphenols
Direct Parent methoxyphenols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl aryl ethers
  • anisoles
  • aromatic alcohols
  • benzoyl derivatives
  • benzyl alcohols
  • hydrocarbon derivatives
  • hydroxybenzaldehydes
  • methoxybenzenes
  • organic oxides
  • phenoxy compounds
  • Substituents
  • aromatic alcohol
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • methoxyphenol
  • alkyl aryl ether
  • organic oxide
  • aryl-aldehyde
  • alcohol
  • aldehyde
  • benzyl alcohol
  • methoxybenzene
  • aromatic homomonocyclic compound
  • benzaldehyde
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • phenoxy compound
  • hydroxybenzaldehyde
  • organooxygen compound