Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:02:57 UTC
Update Date2025-03-24 20:08:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01354251
Frequency1.0
Structure
Chemical FormulaC8H14O2
Molecular Mass142.0994
SMILESCC1(C)CC2CC(C)(O2)O1
InChI KeyHEDOMOSDOJMYMM-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-dioxanes
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • oxanes
  • oxetanes
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxacycle
  • ketal
  • oxetane
  • hydrocarbon derivative
  • oxane
  • meta-dioxane
  • organoheterocyclic compound