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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:38:37 UTC
Update Date2025-03-24 13:59:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00719293
Frequency2.1
Structure
Chemical FormulaC5H7N3O
Molecular Mass125.0589
SMILESNC(=O)c1cc(N)c[nH]1
InChI KeyVXBFGKZOUGTOBF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrroles
Subclass pyrrole carboxylic acids and derivatives
Direct Parent pyrrole carboxamides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-heteroaryl carboxamides
  • amino acids and derivatives
  • azacyclic compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • aromatic heteromonocyclic compound
  • azacycle
  • amino acid or derivatives
  • heteroaromatic compound
  • carboxamide group
  • carboxylic acid derivative
  • 2-heteroaryl carboxamide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • pyrrole-2-carboxamide
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound