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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:44:50 UTC
Update Date2025-03-24 14:02:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00734278
Frequency2.1
Structure
Chemical FormulaC3H8ClN3
Molecular Mass121.0407
SMILESNC(N)=NCCCl
InChI KeyKWULCRGWFZACSD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass guanidines
Direct Parent guanidines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl chlorides
  • carboximidamides
  • hydrocarbon derivatives
  • organochlorides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • guanidine
  • alkyl chloride
  • organochloride
  • organic 1,3-dipolar compound
  • carboximidamide
  • organohalogen compound
  • propargyl-type 1,3-dipolar organic compound
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative