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Record Information
HMDB Statusexpected
Creation Date2024-02-21 00:03:42 UTC
Update Date2025-03-21 18:28:18 UTC
HMDB IDHMDB0060321
Metabolite Identification
DeepMet IDDMID00071018
Name1-Hydroxy-6-methoxypyrene
Frequency42.3
Structure
Chemical FormulaC17H12O2
Molecular Mass248.0837
SMILESCOc1ccc2ccc3c(O)ccc4ccc1c2c43
InChI KeyBVDKRJLKWHAGMW-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
  • alkyl aryl ethers
  • anisoles
  • hydrocarbon derivatives
  • naphthols and derivatives
  • phenanthrols
    • Substituents
  • phenol ether
  • phenanthrene
  • ether
  • phenanthrol
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • alkyl aryl ether
  • pyrene
  • naphthalene
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • 1-naphthol
  • 2-naphthol
  • organooxygen compound