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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:53 UTC
Update Date2025-03-25 00:51:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02189677
Frequency0.5
Structure
Chemical FormulaC19H26O7
Molecular Mass366.1679
SMILESCC(C)Cc1ccc(C(C)C(=O)OCC2OC(=O)C(O)C(O)C2O)cc1
InChI KeyJOBNWVDZSVQDIX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass terpene lactones
Direct Parent terpene lactones
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic monoterpenoids
  • carbonyl compounds
  • carboxylic acid esters
  • delta valerolactones
  • dicarboxylic acids and derivatives
  • gluconolactones
  • hydrocarbon derivatives
  • monocyclic monoterpenoids
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • phenylpropanes
  • secondary alcohols
  • Substituents
  • monoterpenoid
  • monocyclic benzene moiety
  • carbonyl group
  • monocyclic monoterpenoid
  • aromatic heteromonocyclic compound
  • delta valerolactone
  • monosaccharide
  • p-cymene
  • carboxylic acid derivative
  • lactone
  • phenylpropane
  • terpene lactone
  • saccharide
  • organic oxide
  • gluconolactone
  • oxane
  • delta_valerolactone
  • organoheterocyclic compound
  • alcohol
  • oxacycle
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • aromatic monoterpenoid