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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:57 UTC
Update Date2025-03-25 00:49:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02176097
Frequency0.5
Structure
Chemical FormulaC6H11N5O
Molecular Mass169.0964
SMILESNCCc1nc(N)c(C(N)=O)[nH]1
InChI KeyOKPJTGGQFZUAES-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent 2,4,5-trisubstituted imidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-heteroaryl carboxamides
  • amino acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carbonylimidazoles
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • monoalkylamines
  • organic oxides
  • organopnictogen compounds
  • primary carboxylic acid amides
  • vinylogous amides
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • carboxylic acid derivative
  • 2-heteroaryl carboxamide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • imidazole-4-carbonyl group
  • imidolactam
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • 2,4,5-trisubstituted-imidazole
  • carboxamide group
  • organic oxygen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound