Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:39:41 UTC
Update Date2025-03-25 00:22:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01298853
Frequency1.0
Structure
Chemical FormulaC4H9ClOS
Molecular Mass140.0063
SMILESCC(Cl)C(O)CS
InChI KeyDYRXIZUJOYGHGQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classhalohydrins
Subclass chlorohydrins
Direct Parent chlorohydrins
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl chlorides
  • alkylthiols
  • hydrocarbon derivatives
  • organochlorides
  • organosulfur compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • chlorohydrin
  • alkyl chloride
  • organochloride
  • organosulfur compound
  • organic oxygen compound
  • secondary alcohol
  • alkyl halide
  • hydrocarbon derivative
  • alkylthiol
  • organooxygen compound