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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:57 UTC
Update Date2025-03-25 00:50:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02182947
Frequency0.5
Structure
Chemical FormulaC20H18O10
Molecular Mass418.09
SMILESO=c1cc(-c2ccc(O)c(O)c2)oc2cc(OC3OC(CO)C(O)C3O)cc(O)c12
InChI KeyXCOCQBWHCJBRMO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classflavonoids
Subclass flavonoid glycosides
Direct Parent flavonoid-7-o-glycosides
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • 3'-hydroxyflavonoids
  • 4'-hydroxyflavonoids
  • 5-hydroxyflavonoids
  • acetals
  • benzene and substituted derivatives
  • chromones
  • flavonoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • phenol ethers
  • primary alcohols
  • pyranones and derivatives
  • secondary alcohols
  • tetrahydrofurans
  • vinylogous acids
    • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • 1-benzopyran
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • saccharide
  • organic oxide
  • acetal
  • chromone
  • aromatic heteropolycyclic compound
  • pyranone
  • primary alcohol
  • organoheterocyclic compound
  • flavonoid-7-o-glycoside
  • alcohol
  • benzopyran
  • tetrahydrofuran
  • heteroaromatic compound
  • 5-hydroxyflavonoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • 3'-hydroxyflavonoid
  • oxacycle
  • vinylogous acid
  • organic oxygen compound
  • pyran
  • secondary alcohol
  • 4'-hydroxyflavonoid
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound