Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:06:50 UTC
Update Date2025-03-24 16:40:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00930789
Frequency1.5
Structure
Chemical FormulaC4H7ClO2
Molecular Mass122.0135
SMILESCC(=O)C(O)CCl
InChI KeyWINBHPGVRHPAIN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent acyloins
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl chlorides
  • alpha-hydroxy ketones
  • chlorohydrins
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • chlorohydrin
  • halohydrin
  • alkyl chloride
  • organochloride
  • alpha-hydroxy ketone
  • organohalogen compound
  • ketone
  • organic oxide
  • acyloin
  • secondary alcohol
  • alkyl halide
  • hydrocarbon derivative