Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:07:42 UTC
Update Date2025-03-25 00:56:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02219149
Frequency0.5
Structure
Chemical FormulaC21H14O
Molecular Mass282.1045
SMILESCOc1ccc2ccc3cccc4ccc5c(ccc1c25)c34
InChI KeyGARGBRUUXZHHKP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenanthrenes and derivatives
Subclass chrysenes
Direct Parent chrysenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • hydrocarbon derivatives
  • naphthalenes
  • Substituents
  • phenol ether
  • ether
  • aromatic homopolycyclic compound
  • alkyl aryl ether
  • chrysene
  • naphthalene
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • organooxygen compound