Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:07:52 UTC
Update Date2025-03-24 14:12:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00789401
Frequency1.9
Structure
Chemical FormulaC6H14O2
Molecular Mass118.0994
SMILESCCC(C)(CO)OC
InChI KeyVCCCOJNCORYLID-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent dialkyl ethers
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • hydrocarbon derivatives
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • hydrocarbon derivative
  • dialkyl ether