Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:46:25 UTC
Update Date2025-03-25 01:34:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02447239
Frequency0.5
Structure
Chemical FormulaC7H16O2
Molecular Mass132.115
SMILESCCOC(CC)C(C)O
InChI KeyAJNNZOZCNLVZEF-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