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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:52 UTC
Update Date2025-03-25 00:47:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159902
Frequency0.5
Structure
Chemical FormulaC7H8Cl4O2S
Molecular Mass295.8999
SMILESO=S1(=O)CC(Cl)C2C(Cl)C(Cl)C(Cl)C21
InChI KeyPVUSUCJGCWBBIG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiolanes
Subclass thiolanes
Direct Parent thiolanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • alkyl chlorides
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
  • sulfones
    • Substituents
  • thiolane
  • aliphatic heteropolycyclic compound
  • organic oxide
  • organic oxygen compound
  • alkyl chloride
  • organochloride
  • alkyl halide
  • hydrocarbon derivative
  • organohalogen compound
  • sulfone