Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:37:38 UTC
Update Date2025-03-21 18:47:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00151721
Frequency16.0
Structure
Chemical FormulaC5H8N2O
Molecular Mass112.0637
SMILESCC(=O)N1CCC=N1
InChI KeyOWQPLIVCAIEJFS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass pyrazolines
Direct Parent pyrazolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetamides
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • azacycle
  • carboxylic acid derivative
  • pyrazoline
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • acetamide
  • organooxygen compound