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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:47 UTC
Update Date2025-03-25 00:47:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159742
Frequency0.5
Structure
Chemical FormulaC17H12O5
Molecular Mass296.0685
SMILESO=c1c(O)coc(-c2ccc(O)cc2)c1-c1ccc(O)cc1
InChI KeyJCVWNWYUYJDUPP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyranones and derivatives
Direct Parent pyranones and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzene and substituted derivatives
  • cyclic ketones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • cyclic ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • pyranone
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound