Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:59:24 UTC
Update Date2025-03-25 01:39:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02477855
Frequency0.5
Structure
Chemical FormulaC4H5FO4
Molecular Mass136.0172
SMILESCC(O)(C(=O)O)C(=O)F
InChI KeyDPSXPLYWHTZDSA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass alpha hydroxy acids and derivatives
Direct Parent alpha hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acyl fluorides
  • carbonyl compounds
  • carboxylic acids
  • fluorohydrins
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organofluorides
  • tertiary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • halohydrin
  • organofluoride
  • alpha-hydroxy acid
  • acyl fluoride
  • fluorohydrin
  • carboxylic acid derivative
  • organohalogen compound
  • acyl halide
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound