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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:16 UTC
Update Date2025-03-25 00:49:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02176841
Frequency0.5
Structure
Chemical FormulaC19H16O11
Molecular Mass420.0693
SMILESO=C1Oc2ccc(OC3OC(C(=O)O)C(O)C(O)C3O)cc2Oc2ccc(O)cc21
InChI KeyVKNNYLAGBLDUBY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classdepsides and depsidones
Subclass depsides and depsidones
Direct Parent depsides and depsidones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,4-dioxepines
  • 1-hydroxy-2-unsubstituted benzenoids
  • acetals
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • diarylethers
  • dicarboxylic acids and derivatives
  • glucuronic acid derivatives
  • hydrocarbon derivatives
  • lactones
  • monosaccharides
  • o-glucuronides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • phenol ethers
  • pyran carboxylic acids
  • secondary alcohols
    • Substituents
  • diaryl ether
  • phenol ether
  • carbonyl group
  • ether
  • carboxylic acid
  • glucuronic acid or derivatives
  • o-glucuronide
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • carboxylic acid derivative
  • pyran carboxylic acid
  • lactone
  • 1-o-glucuronide
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • acetal
  • dioxepine
  • aromatic heteropolycyclic compound
  • oxane
  • organoheterocyclic compound
  • alcohol
  • pyran carboxylic acid or derivatives
  • depsidone
  • hydroxy acid
  • oxacycle
  • organic oxygen compound
  • pyran
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • benzenoid
  • 1,4-dioxepine
  • organooxygen compound