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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:06 UTC
Update Date2025-03-25 00:46:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02153717
Frequency0.5
Structure
Chemical FormulaC9H3F17OS
Molecular Mass481.9633
SMILESCS(=O)C(F)(C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI KeyQKANRCMHLWSNOI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classsulfoxides
Subclass sulfoxides
Direct Parent sulfoxides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • hydrocarbon derivatives
  • organic oxides
  • organofluorides
  • sulfinyl compounds
    • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • alkyl fluoride
  • organofluoride
  • sulfoxide
  • alkyl halide
  • hydrocarbon derivative
  • organohalogen compound