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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:18 UTC
Update Date2025-03-25 00:46:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02158661
Frequency0.5
Structure
Chemical FormulaC5H8Cl2O4
Molecular Mass201.98
SMILESOC1OC(O)C(Cl)C(Cl)C1O
InChI KeyYDHVCSXGWVAOLD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxanes
Subclass oxanes
Direct Parent oxanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkyl chlorides
  • chlorohydrins
  • hemiacetals
  • hydrocarbon derivatives
  • organochlorides
  • oxacyclic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • chlorohydrin
  • halohydrin
  • alkyl chloride
  • organochloride
  • organohalogen compound
  • oxacycle
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hemiacetal
  • alkyl halide
  • hydrocarbon derivative
  • oxane
  • organooxygen compound