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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:19 UTC
Update Date2025-03-25 00:54:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02204267
Frequency0.5
Structure
Chemical FormulaC12H8FN3O
Molecular Mass229.0651
SMILESOc1nc2c(-c3ccc(F)cc3)ccnc2[nH]1
InChI KeyKBBMMVIHCBUAGC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyridines
Subclass imidazopyridines
Direct Parent imidazopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • aryl fluorides
  • azacyclic compounds
  • fluorobenzenes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • imidazoles
  • organofluorides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • Substituents
  • aryl fluoride
  • monocyclic benzene moiety
  • polyhalopyridine
  • imidazopyridine
  • organohalogen compound
  • fluorobenzene
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • azole
  • azacycle
  • organofluoride
  • heteroaromatic compound
  • hydroxypyridine
  • aryl halide
  • pyridine
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • halobenzene
  • organooxygen compound