Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:54:12 UTC
Update Date2025-03-21 18:53:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00190989
Frequency11.9
Structure
Chemical FormulaC4H7FO2
Molecular Mass106.043
SMILESCC(=O)OCCF
InChI KeyPVDYNYCZGYOXAF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent carboxylic acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organofluorides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • alkyl fluoride
  • organofluoride
  • organohalogen compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound