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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:07:03 UTC
Update Date2025-03-24 21:29:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01793894
Frequency0.7
Structure
Chemical FormulaC8H16N2
Molecular Mass140.1313
SMILESCCCC=CCC(N)=NC
InChI KeyKEXDYTUJLGDQJG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amidines
Direct Parent amidines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboximidamides
  • hydrocarbon derivatives
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound