Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:01:32 UTC
Update Date2025-03-21 23:05:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00630873
Frequency2.5
Structure
Chemical FormulaC5H6N2O2
Molecular Mass126.0429
SMILESO=C(CO)n1ccnc1
InChI KeyZNBULCCTERBHEQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent carbonylimidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • azacyclic compounds
  • carbonyl compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • n-acylimidazoles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • alcohol
  • imidazole-1-carbonyl group
  • carbonyl group
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • n-acylimidazole
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • n-substituted imidazole