Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:32:10 UTC
Update Date2025-03-21 20:58:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00419379
Frequency4.3
Structure
Chemical FormulaC6H7ClN2
Molecular Mass142.0298
SMILESNc1ccc(Cl)cc1N
InChI KeyBXIXXXYDDJVHDL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass halobenzenes
Direct Parent chlorobenzenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl chlorides
  • hydrocarbon derivatives
  • organochlorides
  • organopnictogen compounds
  • primary amines
  • Substituents
  • aryl chloride
  • chlorobenzene
  • organochloride
  • organohalogen compound
  • aryl halide
  • aromatic homomonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine