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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:04 UTC
Update Date2025-03-25 00:45:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02151279
Frequency0.5
Structure
Chemical FormulaC9H9N3O
Molecular Mass175.0746
SMILESCn1c(C(N)=O)cc2cccnc21
InChI KeyIHQMYEXMEKYVCV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolopyridines
Subclass pyrrolopyridines
Direct Parent pyrrolopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • 2-heteroaryl carboxamides
  • azacyclic compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methylpyridines
  • n-methylpyrroles
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • primary carboxylic acid amides
  • pyrrole carboxamides
  • substituted pyrroles
    • Substituents
  • primary carboxylic acid amide
  • n-methylpyrrole
  • polyhalopyridine
  • substituted pyrrole
  • carboxylic acid derivative
  • 2-heteroaryl carboxamide
  • organic oxide
  • pyrrole-2-carboxylic acid or derivatives
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • pyrrole-2-carboxamide
  • 2-halopyridine
  • azacycle
  • pyrrolopyridine
  • heteroaromatic compound
  • methylpyridine
  • carboxamide group
  • pyridine
  • organic oxygen compound
  • pyrrole
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound