Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:04:32 UTC
Update Date2025-03-24 14:10:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00781370
Frequency1.9
Structure
Chemical FormulaC6H7ClN+
Molecular Mass128.0262
SMILESC[n+]1cccc(Cl)c1
InChI KeyWGUDVGBIIATHCI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass methylpyridines
Direct Parent n-methylpyridinium compounds
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl chlorides
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic cations
  • organochlorides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyridines and derivatives
  • Substituents
  • aryl chloride
  • n-methylpyridinium
  • aromatic heteromonocyclic compound
  • azacycle
  • organochloride
  • heteroaromatic compound
  • organohalogen compound
  • aryl halide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation