Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:49:01 UTC
Update Date2025-03-25 00:25:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01320873
Frequency1.0
Structure
Chemical FormulaC6H7ClN2
Molecular Mass142.0298
SMILESNc1cccc(Cl)c1N
InChI KeySAIXZIVDXDTYCH-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