Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:18:58 UTC
Update Date2025-03-24 20:00:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01103291
Frequency1.2
Structure
Chemical FormulaC4H7N3O2
Molecular Mass129.0538
SMILESNC(=O)N1CC(O)C=N1
InChI KeyOHSMUFMTWAKSQI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass pyrazolines
Direct Parent pyrazolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • semicarbazides
  • Substituents
  • alcohol
  • carbonyl group
  • carbonic acid derivative
  • azacycle
  • pyrazoline
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • semicarbazide
  • organooxygen compound