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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:21 UTC
Update Date2025-03-21 18:38:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00120801
Frequency21.5
Structure
Chemical FormulaC20H20O11
Molecular Mass436.1006
SMILESO=C1c2c(O)cc(O)cc2OC1c1ccc(O)c(OC2OC(CO)C(O)C(O)C2O)c1
InChI KeyYQKLDGLWZPAVSS-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
  • 1-hydroxy-4-unsubstituted benzenoids
  • acetals
  • alkyl aryl ethers
  • aryl alkyl ketones
  • benzofuranones
  • coumarans
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • phenol ethers
  • phenoxy compounds
  • primary alcohols
  • secondary alcohols
  • vinylogous acids
    • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • aryl alkyl ketone
  • benzofuranone
  • 2-arylbenzofuran flavonoid
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • alkyl aryl ether
  • ketone
  • saccharide
  • organic oxide
  • acetal
  • aromatic heteropolycyclic compound
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • coumaran
  • alcohol
  • benzofuran
  • 1-hydroxy-4-unsubstituted benzenoid
  • oxacycle
  • vinylogous acid
  • organic oxygen compound
  • secondary alcohol
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound
  • aryl ketone