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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:33 UTC
Update Date2025-03-25 00:46:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02157011
Frequency0.5
Structure
Chemical FormulaC19H14O4
Molecular Mass306.0892
SMILESO=C1c2c(O)cc(O)cc2OCC1c1cccc2ccccc12
InChI KeyPPNFZYBEYQDQMF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classisoflavonoids
Subclass isoflavans
Direct Parent isoflavanones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • alkyl aryl ethers
  • aryl alkyl ketones
  • chromones
  • hydrocarbon derivatives
  • naphthalenes
  • organic oxides
  • oxacyclic compounds
  • vinylogous acids
    • Substituents
  • ether
  • aryl alkyl ketone
  • 1-benzopyran
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • isoflavanone
  • ketone
  • organic oxide
  • chromone
  • aromatic heteropolycyclic compound
  • chromane
  • organoheterocyclic compound
  • benzopyran
  • 1-hydroxy-4-unsubstituted benzenoid
  • oxacycle
  • vinylogous acid
  • naphthalene
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • aryl ketone