Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:39:47 UTC
Update Date2025-03-24 20:50:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01585944
Frequency0.8
Structure
Chemical FormulaC4H3Cl2N
Molecular Mass134.9643
SMILESClc1c[nH]c(Cl)c1
InChI KeyNYHAEAOEIVHXBI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classaryl halides
Subclass aryl chlorides
Direct Parent aryl chlorides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organochlorides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • aryl chloride
  • aromatic heteromonocyclic compound
  • azacycle
  • organochloride
  • heteroaromatic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound