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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:58:40 UTC
Update Date2025-03-21 18:05:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00059017
Frequency53.4
Structure
Chemical FormulaC7HF15O2S
Molecular Mass433.9458
SMILESO=S(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI KeyPCGFFOXXPIGVKC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classsulfinic acids and derivatives
Subclass sulfinic acids
Direct Parent sulfinic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkanesulfinic acids and derivatives
  • alkyl fluorides
  • hydrocarbon derivatives
  • organic oxides
  • organofluorides
  • organosulfur compounds
    • Substituents
  • aliphatic acyclic compound
  • alkyl fluoride
  • organofluoride
  • organosulfur compound
  • organohalogen compound
  • sulfinic acid
  • alkanesulfinic acid or derivatives
  • organic oxide
  • organic oxygen compound
  • alkyl halide
  • hydrocarbon derivative