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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:23:15 UTC
Update Date2025-03-24 16:49:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00970458
Frequency1.5
Structure
Chemical FormulaC6H7N3
Molecular Mass121.064
SMILESc1cc2c(cn1)NCN2
InChI KeyQCDORINEQGJFOJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent polyhalopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • pyridines and derivatives
  • secondary alkylarylamines
    • Substituents
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • secondary amine
  • secondary aliphatic/aromatic amine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine