Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:27:38 UTC
Update Date2025-03-21 18:40:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00128572
Frequency19.8
Structure
Chemical FormulaC19H34O6
Molecular Mass358.2355
SMILESCC(=O)OC(C(OC(=O)C(C)C)C(C)C)C(C)(C)COC(=O)C(C)C
InChI KeyGJPAMYUMPXXASJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass tricarboxylic acids and derivatives
Direct Parent tricarboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • tricarboxylic acid or derivatives
  • organooxygen compound