Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:23:09 UTC
Update Date2025-03-24 20:18:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01402326
Frequency0.9
Structure
Chemical FormulaC4H7FO3
Molecular Mass122.0379
SMILESCC(C(=O)O)C(O)F
InChI KeyNGFYQPSQYLFZLL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass beta hydroxy acids and derivatives
Direct Parent beta hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkyl fluorides
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organofluorides
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • alkyl fluoride
  • organofluoride
  • carboxylic acid derivative
  • organohalogen compound
  • beta-hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound