Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:21:22 UTC
Update Date2025-03-21 20:53:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00393614
Frequency4.7
Structure
Chemical FormulaC4H8F2O2
Molecular Mass126.0492
SMILESCC(O)(CO)C(F)F
InChI KeyACUZFPMCAYSWJK-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