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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:46 UTC
Update Date2025-03-25 00:47:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159692
Frequency0.5
Structure
Chemical FormulaC15H10O5
Molecular Mass270.0528
SMILESO=c1cc(Oc2ccc(O)cc2)oc2ccc(O)cc12
InChI KeyQLRPSTPAPSFRTK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classcoumarins and derivatives
Subclass coumarins and derivatives
Direct Parent coumarins and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • chromones
  • diarylethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • phenol ethers
  • phenoxy compounds
  • pyranones and derivatives
  • vinylogous esters
  • Substituents
  • diaryl ether
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • benzopyran
  • 1-benzopyran
  • vinylogous ester
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • coumarin
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • chromone
  • aromatic heteropolycyclic compound
  • pyran
  • pyranone
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organoheterocyclic compound
  • organooxygen compound