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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:27 UTC
Update Date2025-03-25 00:59:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02236619
Frequency0.5
Structure
Chemical FormulaC12H9NO2
Molecular Mass199.0633
SMILESOc1cc(O)c2c(ccc3cc[nH]c32)c1
InChI KeyJXUGQLDYRSRULH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthols and derivatives
Direct Parent naphthols and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • indoles
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • azacycle
  • indole
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • indole or derivatives
  • 1-hydroxy-4-unsubstituted benzenoid
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 1-naphthol
  • organic nitrogen compound
  • 2-naphthol
  • organoheterocyclic compound
  • organooxygen compound