Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:55:35 UTC
Update Date2025-03-24 18:01:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01047609
Frequency1.3
Structure
Chemical FormulaC6H9FO2
Molecular Mass132.0587
SMILESO=C(O)C1(F)CCCC1
InChI KeyLWWXIFDDFXCLPS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass alpha-halocarboxylic acids and derivatives
Direct Parent alpha-halocarboxylic acids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • alkyl fluorides
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organofluorides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • alkyl fluoride
  • organofluoride
  • alpha-halocarboxylic acid
  • organohalogen compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic homomonocyclic compound
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound