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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:34 UTC
Update Date2025-03-25 00:54:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02204855
Frequency0.5
Structure
Chemical FormulaC4H3Cl5O2S
Molecular Mass289.8296
SMILESO=S1(=O)C(Cl)C(Cl)C(Cl)(Cl)C1Cl
InChI KeyNMOIZAODANODHS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiolanes
Subclass thiolanes
Direct Parent thiolanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkyl chlorides
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
  • sulfones
    • Substituents
  • thiolane
  • organic oxide
  • organic oxygen compound
  • alkyl chloride
  • organochloride
  • aliphatic heteromonocyclic compound
  • alkyl halide
  • hydrocarbon derivative
  • organohalogen compound
  • sulfone