Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:24:21 UTC
Update Date2025-03-21 23:16:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00684884
Frequency2.3
Structure
Chemical FormulaC6H9N3O
Molecular Mass139.0746
SMILESCN(C)C(=O)n1ccnc1
InChI KeyDQLTWJREEUSJEQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent carbonylimidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • n-substituted imidazoles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • ureas
  • Substituents
  • imidazole-1-carbonyl group
  • carbonyl group
  • carbonic acid derivative
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • urea
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • n-substituted imidazole