Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:59:35 UTC
Update Date2025-03-21 18:55:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00203304
Frequency10.9
Structure
Chemical FormulaC8H16O2
Molecular Mass144.115
SMILESCC1(C)COC(C)(C)OC1
InChI KeyYIBHANDRZWPYTI-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-dioxanes
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • ketal
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • meta-dioxane
  • organoheterocyclic compound