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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:36:50 UTC
Update Date2025-03-21 17:57:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00008062
Frequency933.1
Structure
Chemical FormulaC9H7NO3
Molecular Mass177.0426
SMILESOc1cc(O)c2cccc(O)c2n1
InChI KeyLXBDEBBMABEMNY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass hydroxyquinolines
Direct Parent hydroxyquinolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • 2-halopyridines
  • 8-hydroxyquinolines
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • quinolones and derivatives
  • Substituents
  • quinolone
  • 8-hydroxyquinoline
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • hydroxypyridine
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • dihydroxyquinoline
  • hydroxyquinoline
  • pyridine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • 2-halopyridine
  • organic nitrogen compound
  • organooxygen compound