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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:10:36 UTC
Update Date2025-03-25 00:57:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02225741
Frequency0.5
Structure
Chemical FormulaC20H38O5
Molecular Mass358.2719
SMILESCC(C)C(=O)OCC(C)(C)C(OC(=O)OC(C(C)C)C(C)C)C(C)C
InChI KeyKSPSVJBGZOUKSW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic carbonic acids and derivatives
Subclass carbonic acid diesters
Direct Parent carbonic acid diesters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • 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
  • carbonic acid diester
  • hydrocarbon derivative
  • carboxylic acid derivative
  • organooxygen compound