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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:04 UTC
Update Date2025-03-25 00:46:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155960
Frequency0.5
Structure
Chemical FormulaC5H9Cl5N+
Molecular Mass257.9172
SMILESC[N+](C)(C)C(Cl)(Cl)C(Cl)(Cl)Cl
InChI KeyKCPHFTSLAYKXOK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass quaternary ammonium salts
Direct Parent tetraalkylammonium salts
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl chlorides
  • amines
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organochlorides
  • organopnictogen compounds
    • Substituents
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • alkyl chloride
  • organochloride
  • organohalogen compound
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • amine