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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:50 UTC
Update Date2025-03-25 00:47:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159833
Frequency0.5
Structure
Chemical FormulaC12H7NO3
Molecular Mass213.0426
SMILESO=c1ccc2cnc3c(O)cccc3c2o1
InChI KeyFIUNYWZBKCHWOE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass quinolones and derivatives
Direct Parent pyranoquinolines
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
  • lactones
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • polyhalopyridines
  • pyranones and derivatives
  • pyranopyridines
  • Substituents
  • polyhalopyridine
  • 1-hydroxy-2-unsubstituted benzenoid
  • pyranoquinoline
  • lactone
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • pyranone
  • organopnictogen compound
  • 2-halopyridine
  • 8-hydroxyquinoline
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • 1-hydroxy-4-unsubstituted benzenoid
  • oxacycle
  • pyridine
  • organic oxygen compound
  • pyran
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • pyranopyridine
  • organooxygen compound