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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:28 UTC
Update Date2025-03-25 00:50:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02179560
Frequency0.5
Structure
Chemical FormulaC16H14O2
Molecular Mass238.0994
SMILESOc1ccc2c(c1)OCC1c3ccccc3CC21
InChI KeyBZTSEJRIQKFZLW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classisoflavonoids
Subclass isoflavans
Direct Parent isoflavans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-benzopyrans
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl aryl ethers
  • hydrocarbon derivatives
  • indanes
  • oxacyclic compounds
    • Substituents
  • isoflavan
  • ether
  • benzopyran
  • 1-benzopyran
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • indane
  • chromane
  • hydrocarbon derivative
  • benzenoid
  • organoheterocyclic compound
  • organooxygen compound