Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:10 UTC
Update Date2025-03-25 00:54:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02203933
Frequency0.5
Structure
Chemical FormulaC6H11ClO4
Molecular Mass182.0346
SMILESOCC1COC(CO)(CCl)O1
InChI KeyPFYKTGIYBOYHGY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent ketals
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • alkyl chlorides
  • hydrocarbon derivatives
  • organochlorides
  • oxacyclic compounds
  • primary alcohols
  • Substituents
  • alcohol
  • meta-dioxolane
  • alkyl chloride
  • organochloride
  • organohalogen compound
  • oxacycle
  • ketal
  • aliphatic heteromonocyclic compound
  • alkyl halide
  • hydrocarbon derivative
  • primary alcohol
  • organoheterocyclic compound