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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:13:53 UTC
Update Date2025-03-21 18:33:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00095309
Frequency29.1
Structure
Chemical FormulaC19H26O7
Molecular Mass366.1679
SMILESCC(C)Cc1ccc(C(C)C(=O)OC2OC(C(=O)O)CC(O)C2O)cc1
InChI KeyXDBFEUZCAXPDAE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent aromatic monoterpenoids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • acetals
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • monocyclic monoterpenoids
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • phenylpropanes
  • pyran carboxylic acids
  • secondary alcohols
    • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • monocyclic monoterpenoid
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • p-cymene
  • carboxylic acid derivative
  • pyran carboxylic acid
  • phenylpropane
  • organic oxide
  • acetal
  • oxane
  • organoheterocyclic compound
  • 1,2-diol
  • alcohol
  • pyran carboxylic acid or derivatives
  • oxacycle
  • organic oxygen compound
  • pyran
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • aromatic monoterpenoid