Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:53 UTC
Update Date2025-03-25 00:50:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02178289
Frequency0.5
Structure
Chemical FormulaC7H4F10O3
Molecular Mass326.0001
SMILESCOC(=O)C(O)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI KeyAZHXOHPYFFHRLM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acid esters
Direct Parent fatty acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkyl fluorides
  • alpha-halocarboxylic acid derivatives
  • carbonyl compounds
  • fluorohydrins
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
  • organofluorides
  • Substituents
  • alcohol
  • alpha-halocarboxylic acid or derivatives
  • aliphatic acyclic compound
  • carbonyl group
  • halohydrin
  • alkyl fluoride
  • organofluoride
  • fluorohydrin
  • carboxylic acid derivative
  • organohalogen compound
  • alpha-halocarboxylic acid derivative
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • carboxylic acid ester
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound