Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:16:18 UTC
Update Date2025-03-21 18:34:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00101251
Frequency27.0
Structure
Chemical FormulaC8H11Cl3O2
Molecular Mass243.9825
SMILESCC1(C)OC2C(Cl)C(Cl)C(Cl)C2O1
InChI KeyDDBBEMRTKSTBMV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent ketals
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • alkyl chlorides
  • hydrocarbon derivatives
  • organochlorides
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • meta-dioxolane
  • alkyl chloride
  • organochloride
  • organohalogen compound
  • aliphatic heteropolycyclic compound
  • oxacycle
  • ketal
  • alkyl halide
  • hydrocarbon derivative
  • organoheterocyclic compound