Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:23 UTC
Update Date2025-03-21 18:36:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00111270
Frequency23.9
Structure
Chemical FormulaC7H6Cl2O3S
Molecular Mass239.9415
SMILESCS(=O)(=O)Oc1ccc(Cl)cc1Cl
InChI KeyHWTBOKMYXXIASI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass halobenzenes
Direct Parent dichlorobenzenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl chlorides
  • hydrocarbon derivatives
  • methanesulfonates
  • organic oxides
  • organochlorides
  • organooxygen compounds
  • organosulfonic acid esters
  • phenoxy compounds
  • sulfonic acid esters
  • sulfonyls
  • Substituents
  • aryl chloride
  • organosulfonic acid or derivatives
  • organochloride
  • organosulfur compound
  • organohalogen compound
  • organosulfonic acid ester
  • aryl halide
  • 1,3-dichlorobenzene
  • aromatic homomonocyclic compound
  • sulfonic acid ester
  • methanesulfonate
  • organic oxide
  • sulfonyl
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound