Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:25:37 UTC
Update Date2025-03-21 19:15:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00263448
Frequency7.8
Structure
Chemical FormulaC4H5F3O2
Molecular Mass142.0242
SMILESCC(=O)C(O)C(F)(F)F
InChI KeyNUVQBEQNSKENNY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent acyloins
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • alpha-hydroxy ketones
  • fluorohydrins
  • hydrocarbon derivatives
  • organic oxides
  • organofluorides
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • halohydrin
  • alkyl fluoride
  • organofluoride
  • fluorohydrin
  • alpha-hydroxy ketone
  • organohalogen compound
  • ketone
  • organic oxide
  • acyloin
  • secondary alcohol
  • alkyl halide
  • hydrocarbon derivative