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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:29 UTC
Update Date2025-03-25 00:47:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159066
Frequency0.5
Structure
Chemical FormulaC17H19O9+
Molecular Mass367.1024
SMILESOCC1OC(Oc2cc(O)cc(-c3ccc(O)cc3)[o+]2)C(O)C(O)C1O
InChI KeyBHDKINVJPRMPDG-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • benzene and substituted derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monosaccharides
  • organic cations
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
    • Substituents
  • alcohol
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • secondary alcohol
  • hydrocarbon derivative
  • organic cation
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • organooxygen compound