Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:42:28 UTC
Update Date2025-03-24 20:51:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01591943
Frequency0.8
Structure
Chemical FormulaC4H7FO3
Molecular Mass122.0379
SMILESO=C(CO)C(F)CO
InChI KeyRGGBJBNWCNBLKD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • alpha-haloketones
  • alpha-hydroxy ketones
  • beta-hydroxy ketones
  • fluorohydrins
  • hydrocarbon derivatives
  • organic oxides
  • organofluorides
  • primary alcohols
  • Substituents
  • alcohol
  • beta-hydroxy ketone
  • aliphatic acyclic compound
  • carbonyl group
  • halohydrin
  • alkyl fluoride
  • organofluoride
  • monosaccharide
  • fluorohydrin
  • alpha-hydroxy ketone
  • organohalogen compound
  • ketone
  • organic oxide
  • alpha-haloketone
  • alkyl halide
  • hydrocarbon derivative
  • primary alcohol