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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:00:04 UTC
Update Date2025-03-25 00:53:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02201418
Frequency0.5
Structure
Chemical FormulaC13H14O4
Molecular Mass234.0892
SMILESCOc1cc2c(cc1O)CC(O)C1OC=CC21
InChI KeyWQBQYLSMOSPJFY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classnaphthofurans
Subclass naphthofurans
Direct Parent naphthofurans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl aryl ethers
  • anisoles
  • dihydrofurans
  • hydrocarbon derivatives
  • oxacyclic compounds
  • secondary alcohols
  • tetralins
    • Substituents
  • alcohol
  • tetralin
  • phenol ether
  • ether
  • naphthofuran
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • dihydrofuran