Hmdb loader
Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:35:29 UTC
Update Date2025-03-21 17:56:59 UTC
HMDB IDHMDB0033745
Metabolite Identification
DeepMet IDDMID00004962
NameEthyl 2-methylbutyrate
Frequency1101.4
Structure
Chemical FormulaC7H14O2
Molecular Mass130.0994
SMILESCCOC(=O)C(C)CC
InChI KeyHCRBXQFHJMCTLF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acid esters
Direct Parent fatty acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • fatty acid ester
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • carboxylic acid derivative
  • organooxygen compound