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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:07 UTC
Update Date2025-03-25 00:50:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02178785
Frequency0.5
Structure
Chemical FormulaC13H12O
Molecular Mass184.0888
SMILESc1ccc2cc3c(cc2c1)CCOC3
InChI KeyCMFRBCZLXCATOS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classnaphthopyrans
Subclass naphthopyrans
Direct Parent naphthopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-benzopyrans
  • dialkyl ethers
  • hydrocarbon derivatives
  • naphthalenes
  • oxacyclic compounds
  • pyrans
    • Substituents
  • benzopyran
  • ether
  • dialkyl ether
  • oxacycle
  • naphthopyran
  • naphthalene
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyran
  • 2-benzopyran
  • isochromane
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound