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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:35 UTC
Update Date2025-03-25 00:45:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150165
Frequency0.5
Structure
Chemical FormulaC18H20O6
Molecular Mass332.126
SMILESCOc1cc2c(cc1O)OC(c1ccc(OC)c(OC)c1)C2CO
InChI KeyHNTJCYFUGHIIJW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Class2-arylbenzofuran flavonoids
Subclass 2-arylbenzofuran flavonoids
Direct Parent 2-arylbenzofuran flavonoids
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl aryl ethers
  • anisoles
  • coumarans
  • dimethoxybenzenes
  • hydrocarbon derivatives
  • oxacyclic compounds
  • phenoxy compounds
  • primary alcohols
    • Substituents
  • alcohol
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • 2-arylbenzofuran flavonoid
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • methoxybenzene
  • dimethoxybenzene
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • o-dimethoxybenzene
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • primary alcohol
  • organoheterocyclic compound
  • coumaran
  • organooxygen compound