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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:22 UTC
Update Date2025-03-25 00:58:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02229577
Frequency0.5
Structure
Chemical FormulaC9H19N3
Molecular Mass169.1579
SMILESCCCC=CCNC(=NC)NC
InChI KeyJPUDQMLOXHBMEG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass guanidines
Direct Parent guanidines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboximidamides
  • hydrocarbon derivatives
  • imines
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • guanidine
  • imine
  • organopnictogen compound
  • hydrocarbon derivative
  • organic 1,3-dipolar compound
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound