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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:12 UTC
Update Date2025-03-25 00:50:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02183485
Frequency0.5
Structure
Chemical FormulaC14H10O4
Molecular Mass242.0579
SMILESO=C(O)c1ccc2c(c1)COc1cc(O)ccc1-2
InChI KeyNQLBIGUUORJYIP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent dibenzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 2-benzopyrans
  • alkyl aryl ethers
  • benzenoids
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
    • Substituents
  • ether
  • carboxylic acid
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • carboxylic acid derivative
  • dibenzopyran
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • 2-benzopyran
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound