Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:33:05 UTC
Update Date2025-03-25 01:05:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02276964
Frequency0.5
Structure
Chemical FormulaC4H5FO2
Molecular Mass104.0274
SMILESCC(=CF)C(=O)O
InChI KeyPWRRNECAYDKCHZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classvinyl halides
Subclass vinylogous halides
Direct Parent vinylogous halides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • fluoroalkenes
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organofluorides
  • vinyl fluorides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • organofluoride
  • vinyl fluoride
  • carboxylic acid derivative
  • vinylogous halide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • haloalkene
  • hydrocarbon derivative
  • fluoroalkene
  • organooxygen compound