Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:39:35 UTC
Update Date2025-03-21 17:58:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00014479
Frequency304.3
Structure
Chemical FormulaC11H16O5
Molecular Mass228.0998
SMILESCOc1cc(C(O)CO)cc(OC)c1OC
InChI KeyVRYUDXCGWXDNLR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass anisoles
Direct Parent anisoles
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1,2-diols
  • alkyl aryl ethers
  • aromatic alcohols
  • hydrocarbon derivatives
  • methoxybenzenes
  • phenoxy compounds
  • primary alcohols
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • monocyclic benzene moiety
  • ether
  • alkyl aryl ether
  • methoxybenzene
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • anisole
  • secondary alcohol
  • hydrocarbon derivative
  • phenoxy compound
  • primary alcohol
  • organooxygen compound
  • 1,2-diol