Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:28:06 UTC
Update Date2025-03-24 22:14:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01125590
Frequency1.2
Structure
Chemical FormulaC4H11ClNO+
Molecular Mass124.0524
SMILESC[N+](C)(C)C(O)Cl
InChI KeyINOAASUOIKWMTI-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
  • alkanolamines
  • alkyl chlorides
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organochlorides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • alkyl chloride
  • organochloride
  • organohalogen compound
  • organic oxygen compound
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • organooxygen compound
  • alkanolamine