Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:37 UTC
Update Date2025-03-25 00:47:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02163847
Frequency0.5
Structure
Chemical FormulaC12H20O4
Molecular Mass228.1362
SMILESCC1(C)OC2CC3(C)OC(C)(C)OC3C2O1
InChI KeyDLWSRYDRUUSADL-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
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxacycle
  • meta-dioxolane
  • ketal
  • hydrocarbon derivative
  • organoheterocyclic compound