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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:56 UTC
Update Date2025-03-25 00:57:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222037
Frequency0.5
Structure
Chemical FormulaC16H10O3
Molecular Mass250.063
SMILESOc1cc2c(O)cc(O)c3ccc4cccc1c4c32
InChI KeyGUHTYZYMEJVKDG-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