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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:00:54 UTC
Update Date2025-03-21 18:06:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00064275
Frequency47.9
Structure
Chemical FormulaC14H12O2
Molecular Mass212.0837
SMILESOc1ccc(C2COc3ccccc32)cc1
InChI KeyJNYPGGXPQXMCBB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classcoumarans
Subclass 1-phenylcoumarans
Direct Parent 1-phenylcoumarans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl aryl ethers
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • oxacyclic compounds
    • Substituents
  • monocyclic benzene moiety
  • ether
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • 1-phenylcoumaran