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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:23:00 UTC
Update Date2025-03-25 01:02:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02253880
Frequency0.5
Structure
Chemical FormulaC23H36O11
Molecular Mass488.2258
SMILESCC(C)Cc1ccc(COC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)cc1
InChI KeyZCMKWXZFAZCOGF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
    • Substituents
  • alcohol
  • aromatic heteromonocyclic compound
  • monosaccharide
  • phenylpropane
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • secondary alcohol
  • hydrocarbon derivative
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • organooxygen compound