Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:17:08 UTC
Update Date2025-03-24 14:15:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00811469
Frequency1.8
Structure
Chemical FormulaC4H9FO2
Molecular Mass108.0587
SMILESCC(O)(CO)CF
InChI KeyLFQMFJXIQOEZLG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-diols
  • alkyl fluorides
  • fluorohydrins
  • hydrocarbon derivatives
  • organofluorides
  • Substituents
  • aliphatic acyclic compound
  • halohydrin
  • alkyl fluoride
  • organofluoride
  • fluorohydrin
  • organohalogen compound
  • tertiary alcohol
  • alkyl halide
  • hydrocarbon derivative
  • 1,2-diol