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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:10 UTC
Update Date2025-03-21 18:40:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00129839
Frequency19.6
Structure
Chemical FormulaC15H12O4
Molecular Mass256.0736
SMILESCOc1cc2c(-c3ccc(O)cc3)coc2cc1O
InChI KeyPQRDJUXXLFJLPJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzofurans
Subclass phenylbenzofurans
Direct Parent phenylbenzofurans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl aryl ethers
  • anisoles
  • benzene and substituted derivatives
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • oxacyclic compounds
    • Substituents
  • furan
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • phenylbenzofuran
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound