Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:45:34 UTC
Update Date2025-03-21 20:02:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00309290
Frequency6.4
Structure
Chemical FormulaC3H5N2O2+
Molecular Mass101.0346
SMILESO=C1CC[N+](=O)N1
InChI KeyOXTMJELOADLLGH-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolidines
Subclass pyrazolidines
Direct Parent pyrazolidinones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organic oxoazanium compounds
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • azacycle
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • pyrazolidinone
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic oxoazanium
  • organooxygen compound