Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:40:14 UTC
Update Date2025-03-25 00:22:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01300141
Frequency1.0
Structure
Chemical FormulaC6H14O2
Molecular Mass118.0994
SMILESCCOCC(C)(C)O
InChI KeyBCYNAHGOLUTMDM-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
  • Substituents
  • aliphatic acyclic compound
  • tertiary alcohol
  • ether
  • hydrocarbon derivative
  • dialkyl ether