Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:12:59 UTC
Update Date2025-03-25 00:36:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02092831
Frequency0.6
Structure
Chemical FormulaC6H9FO2
Molecular Mass132.0587
SMILESCCCC(=O)C(=O)CF
InChI KeyGJYAYLBQHOXGOB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-diketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • alpha-haloketones
  • hydrocarbon derivatives
  • organic oxides
  • organofluorides
  • Substituents
  • aliphatic acyclic compound
  • alkyl fluoride
  • organofluoride
  • organohalogen compound
  • alpha-diketone
  • organic oxide
  • alpha-haloketone
  • alkyl halide
  • hydrocarbon derivative