Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:53:03 UTC
Update Date2025-03-24 20:31:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01472944
Frequency0.9
Structure
Chemical FormulaC4H5ClF2O
Molecular Mass141.9997
SMILESCCC(=O)C(F)(F)Cl
InChI KeySUGPXAGJFKHCGZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-chloroketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl chlorides
  • alkyl fluorides
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
  • organofluorides
  • Substituents
  • aliphatic acyclic compound
  • alkyl fluoride
  • organofluoride
  • alkyl chloride
  • organochloride
  • organohalogen compound
  • alpha-chloroketone
  • organic oxide
  • alkyl halide
  • hydrocarbon derivative