Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:35 UTC
Update Date2025-03-21 18:37:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00114193
Frequency23.1
Structure
Chemical FormulaC4H5F3O
Molecular Mass126.0292
SMILESCC(=O)CC(F)(F)F
InChI KeyBTXXTMOWISPQSJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • hydrocarbon derivatives
  • organic oxides
  • organofluorides
  • Substituents
  • ketone
  • aliphatic acyclic compound
  • organic oxide
  • alkyl fluoride
  • organofluoride
  • alkyl halide
  • hydrocarbon derivative
  • organohalogen compound