Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:02:51 UTC
Update Date2025-03-24 21:53:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01926200
Frequency0.6
Structure
Chemical FormulaC4H8F3NO
Molecular Mass143.0558
SMILESCNCC(O)C(F)(F)F
InChI KeyKUWNPQGEOONMLR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classhalohydrins
Subclass fluorohydrins
Direct Parent fluorohydrins
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • dialkylamines
  • hydrocarbon derivatives
  • organofluorides
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • alkyl fluoride
  • organofluoride
  • secondary amine
  • fluorohydrin
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine