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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:23:12 UTC
Update Date2025-03-25 01:02:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02254346
Frequency0.5
Structure
Chemical FormulaC9H4F16O2S
Molecular Mass479.9677
SMILESCC(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)S(=O)(=O)C(F)(F)F
InChI KeyCEECXUSYTAERJM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classsulfonyls
Subclass sulfones
Direct Parent sulfones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • hydrocarbon derivatives
  • organic oxides
  • organofluorides
  • trihalomethanes
    • Substituents
  • halomethane
  • aliphatic acyclic compound
  • trihalomethane
  • alkyl fluoride
  • organofluoride
  • organohalogen compound
  • organic oxide
  • organic oxygen compound
  • alkyl halide
  • hydrocarbon derivative
  • sulfone