Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:57 UTC
Update Date2025-03-21 18:38:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00122241
Frequency21.2
Structure
Chemical FormulaC13H9O2+
Molecular Mass197.0597
SMILESOc1ccc2c(ccc3ccccc32)[o+]1
InChI KeyFXRDPPFLWGSMQT-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classnaphthopyrans
Subclass naphthopyrans
Direct Parent naphthopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-benzopyrans
  • coumarins and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • naphthalenes
  • organic cations
  • organooxygen compounds
  • oxacyclic compounds
  • pyrans
  • Substituents
  • benzopyran
  • 1-benzopyran
  • heteroaromatic compound
  • coumarin
  • oxacycle
  • naphthopyran
  • naphthalene
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyran
  • hydrocarbon derivative
  • benzenoid
  • organic cation
  • organooxygen compound