Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:19:30 UTC
Update Date2025-03-21 20:52:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00389121
Frequency4.7
Structure
Chemical FormulaC4H7N3O
Molecular Mass113.0589
SMILESNc1nc(CO)c[nH]1
InChI KeyBSPMWFRGZQDRIU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent imidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary amines
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organic oxygen compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound