Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:33:10 UTC
Update Date2025-03-24 20:22:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01426825
Frequency0.9
Structure
Chemical FormulaC6H14O3
Molecular Mass134.0943
SMILESCOC(CO)C(C)(C)O
InChI KeyGCUJHFHLRUEEMB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • primary alcohols
  • Substituents
  • aliphatic acyclic compound
  • tertiary alcohol
  • ether
  • hydrocarbon derivative
  • primary alcohol
  • dialkyl ether