Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:34:50 UTC
Update Date2025-03-21 17:56:46 UTC
HMDB IDHMDB0031703
Metabolite Identification
DeepMet IDDMID00003453
Name2-Ethylbutyl acetate
Frequency1689.3
Structure
Chemical FormulaC8H16O2
Molecular Mass144.115
SMILESCCC(CC)COC(C)=O
InChI KeyHQLKZWRSOHTERR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent carboxylic acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organooxygen compound