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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:19 UTC
Update Date2025-03-21 18:35:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00106217
Frequency25.4
Structure
Chemical FormulaC15H16O9
Molecular Mass340.0794
SMILESO=c1cc(OC2OC(CO)C(O)C(O)C2O)c2ccc(O)cc2o1
InChI KeyYZHPIOLSLRFTIM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classcoumarins and derivatives
Subclass coumarin glycosides
Direct Parent coumarin glycosides
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-benzopyrans
  • 1-hydroxy-2-unsubstituted benzenoids
  • 7-hydroxycoumarins
  • acetals
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactones
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • pyranones and derivatives
  • secondary alcohols
  • vinylogous esters
    • Substituents
  • coumarin o-glycoside
  • 1-benzopyran
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • coumarin-4-o-glycoside
  • lactone
  • saccharide
  • organic oxide
  • acetal
  • aromatic heteropolycyclic compound
  • pyranone
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • benzopyran
  • 7-hydroxycoumarin
  • vinylogous ester
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • pyran
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound