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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:22:09 UTC
Update Date2025-03-25 01:01:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02252039
Frequency0.5
Structure
Chemical FormulaC8H5F14NO
Molecular Mass397.0148
SMILESNCC(O)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI KeyOEMBMNNAQKOYLK-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
  • monoalkylamines
  • organofluorides
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • alkyl fluoride
  • organofluoride
  • fluorohydrin
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound