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Record Information
HMDB Statusexpected
Creation Date2024-02-21 15:11:09 UTC
Update Date2025-03-25 00:57:49 UTC
HMDB IDHMDB0037211
Metabolite Identification
DeepMet IDDMID02226945
NameMenthyl isovalerate
Frequency0.5
Structure
Chemical FormulaC15H28O2
Molecular Mass240.2089
SMILESCC(C)CC(=O)OC1CC(C)CCC1C(C)C
InChI KeyVYQSSWZYPCCBRN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent monocyclic monoterpenoids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • fatty acid esters
  • hydrocarbon derivatives
  • menthane monoterpenoids
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • fatty acyl
  • carbonyl group
  • monocyclic monoterpenoid
  • carboxylic acid derivative
  • p-menthane monoterpenoid
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound