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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:40:07 UTC
Update Date2025-03-24 20:51:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01586659
Frequency0.8
Structure
Chemical FormulaC39H50O24
Molecular Mass902.2692
SMILESCC1OC(OCC2OC(Oc3ccc(-c4oc5cc(O)cc(O)c5c(=O)c4OC4OC(COC5OC(C)C(O)C(O)C5O)C(O)C(O)C4O)cc3)C(O)C(O)C2O)C(O)C(O)C1O
InChI KeyBICQAOAONDCHTL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classflavonoids
Subclass flavonoid glycosides
Direct Parent flavonoid-3-o-glycosides
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • 5-hydroxyflavonoids
  • 7-hydroxyflavonoids
  • acetals
  • chromones
  • flavonoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • phenol ethers
  • phenoxy compounds
  • pyranones and derivatives
  • secondary alcohols
  • vinylogous acids
    • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • 1-benzopyran
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • saccharide
  • organic oxide
  • acetal
  • chromone
  • aromatic heteropolycyclic compound
  • flavonoid-3-o-glycoside
  • pyranone
  • oxane
  • organoheterocyclic compound
  • alcohol
  • benzopyran
  • heteroaromatic compound
  • 5-hydroxyflavonoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • oxacycle
  • vinylogous acid
  • organic oxygen compound
  • pyran
  • 7-hydroxyflavonoid
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound