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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:16:35 UTC
Update Date2025-03-25 00:59:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02239128
Frequency0.5
Structure
Chemical FormulaC8H8N3O2+
Molecular Mass178.0611
SMILESNC(=O)c1cc[n+]2c(c1)NC(=O)C2
InChI KeyIEDZNCKARHOOKW-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyridines
Subclass imidazopyridines
Direct Parent imidazopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • primary carboxylic acid amides
  • pyridinecarboxylic acids and derivatives
  • secondary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • pyridine carboxylic acid or derivatives
  • carbonyl group
  • lactam
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • imidazopyridine
  • carboxamide group
  • carboxylic acid derivative
  • secondary carboxylic acid amide
  • organic oxide
  • pyridine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • organic cation
  • organooxygen compound