Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:34 UTC
Update Date2025-03-25 00:47:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02163722
Frequency0.5
Structure
Chemical FormulaC10H20O3
Molecular Mass188.1412
SMILESCC1(C)CC(C)(CO)OC(C)(C)O1
InChI KeyVSCSLZXLGCTSMI-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
  • alcohols and polyols
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • alcohol
  • oxacycle
  • ketal
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • meta-dioxane
  • organoheterocyclic compound