Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:33 UTC
Update Date2025-03-25 00:51:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02186601
Frequency0.5
Structure
Chemical FormulaC16H13NO2
Molecular Mass251.0946
SMILESNc1ccc(-c2ccc3c(O)cc(O)cc3c2)cc1
InChI KeyVBVFJCWICLQSFW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass phenylnaphthalenes
Direct Parent phenylnaphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • naphthols and derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • Substituents
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • 1-hydroxy-4-unsubstituted benzenoid
  • organic oxygen compound
  • phenylnaphthalene
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 1-naphthol
  • primary amine
  • organic nitrogen compound
  • 2-naphthol
  • amine
  • organooxygen compound