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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:53 UTC
Update Date2025-03-25 01:01:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02246862
Frequency0.5
Structure
Chemical FormulaC12H28N4
Molecular Mass228.2314
SMILESCC=NCCCNCCCCNCCCN
InChI KeyZEMOXXVGOIXMBV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent dialkylamines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldimines
  • hydrocarbon derivatives
  • monoalkylamines
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • imine
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • aldimine
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine