Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:44:57 UTC
Update Date2025-03-24 17:57:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01022073
Frequency1.4
Structure
Chemical FormulaC4H7ClO
Molecular Mass106.0185
SMILESC=CC(O)CCl
InChI KeyPIPLRXXGXUVQRX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classhalohydrins
Subclass chlorohydrins
Direct Parent chlorohydrins
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl chlorides
  • hydrocarbon derivatives
  • organochlorides
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • chlorohydrin
  • alkyl chloride
  • organochloride
  • organic oxygen compound
  • secondary alcohol
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound