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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:23 UTC
Update Date2025-03-25 00:47:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02158850
Frequency0.5
Structure
Chemical FormulaC21H18O6
Molecular Mass366.1103
SMILESOc1ccc(OC2Cc3cc(O)cc(O)c3OC2c2ccc(O)cc2)cc1
InChI KeySTABRJIADIAHLJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classflavonoids
Subclass hydroxyflavonoids
Direct Parent 8-hydroxyflavonoids
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-benzopyrans
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • 4'-hydroxyflavonoids
  • 4-alkoxyphenols
  • 6-hydroxyflavonoids
  • alkyl aryl ethers
  • flavan-3-ols
  • hydrocarbon derivatives
  • oxacyclic compounds
  • phenol ethers
  • phenoxy compounds
    • Substituents
  • 8-hydroxyflavonoid
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • 1-benzopyran
  • flavan
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • aromatic heteropolycyclic compound
  • chromane
  • flavan-3-ol
  • organoheterocyclic compound
  • 4-alkoxyphenol
  • benzopyran
  • 6-hydroxyflavonoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • oxacycle
  • organic oxygen compound
  • 4'-hydroxyflavonoid
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound