Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:57:08 UTC
Update Date2025-03-24 20:57:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01626662
Frequency0.8
Structure
Chemical FormulaC3H6Cl2O
Molecular Mass127.9796
SMILESCCC(O)(Cl)Cl
InChI KeyXEPXTKKIWBPAEG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classalkyl halides
Subclass alkyl chlorides
Direct Parent alkyl chlorides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • hydrocarbon derivatives
  • organochlorides
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • organic oxygen compound
  • alkyl chloride
  • organochloride
  • hydrocarbon derivative
  • organooxygen compound