Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:41:30 UTC
Update Date2025-03-21 18:48:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00160846
Frequency14.8
Structure
Chemical FormulaC4H7F3O
Molecular Mass128.0449
SMILESCCC(O)C(F)(F)F
InChI KeyIBWNUWSYEJOUAH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classhalohydrins
Subclass fluorohydrins
Direct Parent fluorohydrins
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • hydrocarbon derivatives
  • organofluorides
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • alkyl fluoride
  • organofluoride
  • fluorohydrin
  • organic oxygen compound
  • secondary alcohol
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound