Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:27:37 UTC
Update Date2025-03-24 22:13:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01124428
Frequency1.2
Structure
Chemical FormulaC6H14O2
Molecular Mass118.0994
SMILESCCC(O)(CC)OC
InChI KeyHWCHDRCMPNBFLS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent hemiketals
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organooxygen compounds
  • Substituents
  • aliphatic acyclic compound
  • hemiketal
  • hydrocarbon derivative