Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:52:22 UTC
Update Date2025-03-24 18:00:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01039924
Frequency1.3
Structure
Chemical FormulaC6H13ClN+
Molecular Mass134.0731
SMILESC=C(Cl)C[N+](C)(C)C
InChI KeyPUBQQWBVARBARW-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
  • amines
  • chloroalkenes
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organochlorides
  • organopnictogen compounds
  • vinyl chlorides
  • Substituents
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • chloroalkene
  • organochloride
  • organohalogen compound
  • vinyl halide
  • haloalkene
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • vinyl chloride
  • organic salt
  • amine