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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:58 UTC
Update Date2025-03-21 18:37:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00115102
Frequency22.9
Structure
Chemical FormulaC15H12N2O
Molecular Mass236.095
SMILESOc1ccc2c(Nc3ccccc3)ccnc2c1
InChI KeyARNRVISORGUGMG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass quinolines and derivatives
Direct Parent quinolines and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 2-halopyridines
  • azacyclic compounds
  • benzene and substituted derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • secondary amines
  • Substituents
  • monocyclic benzene moiety
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • hydroxypyridine
  • 1-hydroxy-2-unsubstituted benzenoid
  • secondary amine
  • pyridine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • quinoline
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • 2-halopyridine
  • organic nitrogen compound
  • organooxygen compound
  • amine