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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:10:39 UTC
Update Date2025-03-24 20:38:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01515565
Frequency0.8
Structure
Chemical FormulaC4H12N3O+
Molecular Mass118.0975
SMILESCN(C)CC[N+](N)=O
InChI KeyTXANFBXIKXGLBV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent trialkylamines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organic oxoazanium compounds
  • organopnictogen compounds
    • Substituents
  • aliphatic acyclic compound
  • tertiary aliphatic amine
  • organic oxide
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organic oxoazanium