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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:32 UTC
Update Date2025-03-25 00:50:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02182002
Frequency0.5
Structure
Chemical FormulaC6H9F2O9P
Molecular Mass293.9952
SMILESO=C(O)C(F)(F)C(=O)C(O)C(O)COP(=O)(O)O
InChI KeyNCEOJKUUZAOETH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classketo acids and derivatives
Subclass medium-chain keto acids and derivatives
Direct Parent medium-chain keto acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-diols
  • acyloins
  • alkyl fluorides
  • alpha-halocarboxylic acids
  • alpha-haloketones
  • alpha-hydroxy ketones
  • beta-hydroxy ketones
  • beta-keto acids and derivatives
  • carboxylic acids
  • fatty acyls
  • halogenated fatty acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monoalkyl phosphates
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organofluorides
  • secondary alcohols
    • Substituents
  • alpha-halocarboxylic acid or derivatives
  • fatty acyl
  • beta-hydroxy ketone
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • monosaccharide
  • alpha-halocarboxylic acid
  • alpha-hydroxy ketone
  • carboxylic acid derivative
  • organohalogen compound
  • beta-keto acid
  • ketone
  • saccharide
  • organic oxide
  • alpha-haloketone
  • alkyl halide
  • hydroxy fatty acid
  • 1,2-diol
  • halogenated fatty acid
  • alcohol
  • alkyl fluoride
  • organofluoride
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • acyloin
  • secondary alcohol
  • hydrocarbon derivative
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound
  • medium-chain keto acid