Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:03:42 UTC
Update Date2025-03-21 22:08:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00494070
Frequency3.5
Structure
Chemical FormulaC5H7N3O
Molecular Mass125.0589
SMILESNCc1[nH]cnc1C=O
InChI KeyWJUJQNDNYKNBDP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent carbonylimidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl-aldehydes
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • carbonyl group
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • aldehyde
  • organic oxide
  • aryl-aldehyde
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • imidazole-4-carbonyl group
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound