Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:40 UTC
Update Date2025-03-21 18:37:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00114387
Frequency23.1
Structure
Chemical FormulaC16H13NO
Molecular Mass235.0997
SMILESOc1ccccc1Nc1cccc2ccccc12
InChI KeyBBORTBNBSFSTEL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • secondary amines
  • Substituents
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • 1-hydroxy-4-unsubstituted benzenoid
  • secondary amine
  • naphthalene
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine