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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:59:59 UTC
Update Date2025-03-25 00:53:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02201254
Frequency0.5
Structure
Chemical FormulaC14H11O2+
Molecular Mass211.0754
SMILESCOc1cc[o+]c2ccc3ccccc3c12
InChI KeyHWJRVJUZVRLYNX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classnaphthopyrans
Subclass naphthopyrans
Direct Parent naphthopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-benzopyrans
  • alkyl aryl ethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • naphthalenes
  • organic cations
  • oxacyclic compounds
  • pyrans
    • Substituents
  • ether
  • benzopyran
  • 1-benzopyran
  • heteroaromatic compound
  • alkyl aryl ether
  • oxacycle
  • naphthopyran
  • naphthalene
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyran
  • hydrocarbon derivative
  • benzenoid
  • organic cation
  • organooxygen compound