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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:55:39 UTC
Update Date2025-03-21 22:01:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00474937
Frequency3.7
Structure
Chemical FormulaC4H7ClO3
Molecular Mass138.0084
SMILESOCC1OC(O)C1Cl
InChI KeySWLWAYYCLOBQLK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxetanes
Subclass oxetanes
Direct Parent oxetanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkyl chlorides
  • chlorohydrins
  • hemiacetals
  • hydrocarbon derivatives
  • organochlorides
  • oxacyclic compounds
  • primary alcohols
    • Substituents
  • alcohol
  • chlorohydrin
  • halohydrin
  • alkyl chloride
  • organochloride
  • organohalogen compound
  • oxacycle
  • organic oxygen compound
  • oxetane
  • aliphatic heteromonocyclic compound
  • hemiacetal
  • alkyl halide
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound