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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:12:33 UTC
Update Date2025-03-21 18:32:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00092111
Frequency30.4
Structure
Chemical FormulaC13H10O5
Molecular Mass246.0528
SMILESOc1cc(O)c2c(c1)Oc1cc(O)cc(O)c1C2
InChI KeyWRWDLBILCDUPOS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent xanthenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzenoids
  • diarylethers
  • hydrocarbon derivatives
  • oxacyclic compounds
    • Substituents
  • diaryl ether
  • ether
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • xanthene
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound