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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:17 UTC
Update Date2025-03-21 18:41:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00134716
Frequency18.7
Structure
Chemical FormulaC18H10Cl4O4S
Molecular Mass461.9054
SMILESO=S(=O)(Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl)c1ccc(Cl)cc1
InChI KeyVGUVXAHLGZRSAD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylethers
Direct Parent diphenylethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl chlorides
  • arylsulfonic acids and derivatives
  • benzenesulfonate esters
  • benzenesulfonyl compounds
  • diarylethers
  • dichlorobenzenes
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
  • organosulfonic acid esters
  • phenol ethers
  • phenoxy compounds
  • sulfonyls
    • Substituents
  • diaryl ether
  • phenol ether
  • organosulfonic acid or derivatives
  • benzenesulfonate ester
  • ether
  • organochloride
  • benzenesulfonate
  • organosulfur compound
  • organohalogen compound
  • 1,3-dichlorobenzene
  • organic oxide
  • benzenesulfonyl group
  • aryl chloride
  • chlorobenzene
  • organosulfonic acid ester
  • aryl halide
  • aromatic homomonocyclic compound
  • sulfonyl
  • arylsulfonic acid or derivatives
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • hydrocarbon derivative
  • halobenzene
  • phenoxy compound
  • diphenylether
  • organooxygen compound