Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:14 UTC
Update Date2025-03-21 18:39:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00125190
Frequency20.5
Structure
Chemical FormulaC13H11NO
Molecular Mass197.0841
SMILESCOc1ccc2ccc3[nH]ccc3c2c1
InChI KeyIOBZBPXOHJFGPX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • indoles
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • phenol ether
  • ether
  • azacycle
  • indole
  • heteroaromatic compound
  • indole or derivatives
  • alkyl aryl ether
  • naphthalene
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound