Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:00:31 UTC
Update Date2025-03-25 00:53:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02202413
Frequency0.5
Structure
Chemical FormulaC11H16Cl2N+
Molecular Mass232.0654
SMILESC[N+](C)(C)C(c1ccccc1)C(Cl)Cl
InChI KeyPYVHLCOCRLZRDZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent aralkylamines
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl chlorides
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organochlorides
  • organopnictogen compounds
  • tetraalkylammonium salts
  • Substituents
  • monocyclic benzene moiety
  • tetraalkylammonium salt
  • alkyl chloride
  • organochloride
  • quaternary ammonium salt
  • organohalogen compound
  • aralkylamine
  • aromatic homomonocyclic compound
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • benzenoid
  • organic cation
  • organic salt