Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:36:39 UTC
Update Date2025-03-21 18:46:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00149421
Frequency16.3
Structure
Chemical FormulaC6H14O2
Molecular Mass118.0994
SMILESCCOC(C)C(C)O
InChI KeySFFDJWPLFTUFQC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • ether
  • secondary alcohol
  • hydrocarbon derivative
  • dialkyl ether