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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:48:34 UTC
Update Date2025-03-21 18:01:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00035090
Frequency101.9
Structure
Chemical FormulaC16H10O2
Molecular Mass234.0681
SMILESOc1cc2ccc3cccc4ccc(c1O)c2c34
InChI KeyJMLIZQVKDDUDQE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classpyrenes
Subclass pyrenes
Direct Parent pyrenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • hydrocarbon derivatives
  • naphthols and derivatives
  • organooxygen compounds
  • phenanthrols
    • Substituents
  • phenanthrene
  • phenanthrol
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • pyrene
  • naphthalene
  • organic oxygen compound
  • hydrocarbon derivative
  • 1-naphthol
  • 2-naphthol
  • organooxygen compound