Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:23:20 UTC
Update Date2025-03-21 18:38:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00118466
Frequency22.1
Structure
Chemical FormulaC20H22O6
Molecular Mass358.1416
SMILESCOc1cc(C2c3cc4c(cc3C(O)C2C)OCO4)cc(OC)c1OC
InChI KeyDIFMIAGNWLRNQH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzodioxoles
Subclass benzodioxoles
Direct Parent benzodioxoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetals
  • alkyl aryl ethers
  • anisoles
  • hydrocarbon derivatives
  • indanes
  • methoxybenzenes
  • oxacyclic compounds
  • phenoxy compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • alkyl aryl ether
  • methoxybenzene
  • oxacycle
  • organic oxygen compound
  • acetal
  • aromatic heteropolycyclic compound
  • anisole
  • indane
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound
  • benzodioxole