Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:35:02 UTC
Update Date2025-03-24 14:29:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00855093
Frequency1.7
Structure
Chemical FormulaC6H11FO2
Molecular Mass134.0743
SMILESCCC(C)C(F)C(=O)O
InChI KeyHQIXPQDQUCAWDW-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
  • alpha-halocarboxylic acids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • methyl-branched fatty acids
  • monocarboxylic acids and derivatives
  • organic oxides
  • organofluorides
  • Substituents
  • halogenated fatty acid
  • alpha-halocarboxylic acid or derivatives
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • methyl-branched fatty acid
  • alkyl fluoride
  • organofluoride
  • alpha-halocarboxylic acid
  • carboxylic acid derivative
  • organohalogen compound
  • branched fatty acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound