Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-21 00:11:53 UTC
Update Date2025-03-21 18:32:22 UTC
HMDB IDHMDB0059825
Metabolite Identification
DeepMet IDDMID00090479
NameIsoamyl lactate
Frequency31.1
Structure
Chemical FormulaC8H16O3
Molecular Mass160.1099
SMILESCC(C)CCOC(=O)C(C)O
InChI KeyCRORGGSWAKIXSA-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
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound