Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:00:37 UTC
Update Date2025-03-24 19:51:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01059195
Frequency1.3
Structure
Chemical FormulaC5H9FO2
Molecular Mass120.0587
SMILESCC(C)C(O)C(=O)F
InChI KeyKVNXKOMCBWTBJE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classhalohydrins
Subclass fluorohydrins
Direct Parent fluorohydrins
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acyl fluorides
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic oxides
  • organofluorides
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • organofluoride
  • acyl fluoride
  • fluorohydrin
  • acyl halide
  • organic oxide
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound