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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:12 UTC
Update Date2025-03-25 00:58:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02233762
Frequency0.5
Structure
Chemical FormulaC22H30O17
Molecular Mass566.1483
SMILESO=C1c2c(O)cc(O)cc2OC(COC2(CO)OC(CO)C(O)C2O)(OC2OC(CO)C(O)C(O)C2O)C1O
InChI KeyKCFOWAZOEJCMSK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent chromones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • aryl alkyl ketones
  • benzenoids
  • hydrocarbon derivatives
  • ketals
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • tetrahydrofurans
  • vinylogous acids
    • Substituents
  • aryl alkyl ketone
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • ketone
  • saccharide
  • organic oxide
  • acetal
  • chromone
  • aromatic heteropolycyclic compound
  • ketal
  • oxane
  • primary alcohol
  • alcohol
  • tetrahydrofuran
  • 1-hydroxy-4-unsubstituted benzenoid
  • oxacycle
  • vinylogous acid
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • aryl ketone