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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:13 UTC
Update Date2025-03-25 00:58:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02231480
Frequency0.5
Structure
Chemical FormulaC25H32O13
Molecular Mass540.1843
SMILESCC1OC(OCC2OC(Oc3cc(O)ccc3-c3ccc(O)cc3)C(O)C(O)C(O)C2O)C(O)C(O)C1O
InChI KeyFACAWCCSPDSDHC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass phenol ethers
Direct Parent phenol ethers
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • acetals
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • oxepanes
  • phenoxy compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • phenol ether
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • oxepane
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • secondary alcohol
  • phenol
  • hydrocarbon derivative
  • phenoxy compound
  • oxane
  • organoheterocyclic compound
  • organooxygen compound