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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:34 UTC
Update Date2025-03-25 00:59:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02234596
Frequency0.5
Structure
Chemical FormulaC19H18O11
Molecular Mass422.0849
SMILESO=c1c2cc(O)c(O)cc2oc2cc(O)c(OC3OC(CO)C(O)C(O)C3O)cc12
InChI KeyPWMNYNLRCXKCOS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent xanthones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • acetals
  • chromones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • phenol ethers
  • primary alcohols
  • pyranones and derivatives
  • secondary alcohols
    • Substituents
  • phenol ether
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • saccharide
  • organic oxide
  • acetal
  • chromone
  • aromatic heteropolycyclic compound
  • pyranone
  • oxane
  • primary alcohol
  • alcohol
  • xanthone
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • pyran
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound