Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:28:39 UTC
Update Date2025-03-21 19:18:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00270517
Frequency7.6
Structure
Chemical FormulaC5H10O2
Molecular Mass102.0681
SMILESCCOC(C)C=O
InChI KeyCKQJKQXELPQTSS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent dialkyl ethers
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • short-chain aldehydes
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • short-chain aldehyde
  • aldehyde
  • hydrocarbon derivative
  • dialkyl ether