Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:10:49 UTC
Update Date2025-03-25 00:57:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02226227
Frequency0.5
Structure
Chemical FormulaC5H5F3O3
Molecular Mass170.0191
SMILESCC(O)=C(C(=O)O)C(F)(F)F
InChI KeyFVWMWAOYNWFTPK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent halogenated fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • branched fatty acids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monocarboxylic acids and derivatives
  • organic oxides
  • organofluorides
  • short-chain hydroxy acids and derivatives
  • unsaturated fatty acids
  • vinylogous acids
  • Substituents
  • halogenated fatty acid
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • alkyl fluoride
  • organofluoride
  • carboxylic acid derivative
  • organohalogen compound
  • branched fatty acid
  • unsaturated fatty acid
  • vinylogous acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • alkyl halide
  • hydrocarbon derivative
  • hydroxy fatty acid
  • organooxygen compound