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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:27:52 UTC
Update Date2025-03-21 18:40:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00129114
Frequency19.7
Structure
Chemical FormulaC9HF19O
Molecular Mass485.9724
SMILESOC(F)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI KeyIOSPSTLDHCDJTG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classhalohydrins
Subclass fluorohydrins
Direct Parent fluorohydrins
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkyl fluorides
  • hydrocarbon derivatives
  • organofluorides
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • organic oxygen compound
  • alkyl fluoride
  • organofluoride
  • alkyl halide
  • hydrocarbon derivative
  • fluorohydrin
  • organooxygen compound