Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:26:43 UTC
Update Date2025-03-21 22:18:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00548620
Frequency3.0
Structure
Chemical FormulaC4H12N3O+
Molecular Mass118.0975
SMILESNCCCC[N+](N)=O
InChI KeyOTWJKZMPOVKKBA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganic oxoazanium compounds
Subclass organic oxoazanium compounds
Direct Parent organic oxoazanium compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organic cation
  • organic oxoazanium