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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:22 UTC
Update Date2025-03-25 00:47:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02158811
Frequency0.5
Structure
Chemical FormulaC22H14O2
Molecular Mass310.0994
SMILESOc1ccc2c(c1)c1ccc(O)cc1c1c3ccccc3ccc21
InChI KeyPYZRPYRWRQTHJK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslignans, neolignans and related compounds
Classarylnaphthalene lignans
Subclass arylnaphthalene lignans
Direct Parent arylnaphthalene lignans
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • chrysenes
  • hydrocarbon derivatives
  • naphthols and derivatives
  • organooxygen compounds
  • phenanthrols
  • triphenylenes
    • Substituents
  • phenanthrene
  • phenanthrol
  • arylnaphthalene lignan skeleton
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • chrysene
  • triphenylene
  • naphthalene
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • 2-naphthol
  • organooxygen compound