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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:30 UTC
Update Date2025-03-25 00:59:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02234446
Frequency0.5
Structure
Chemical FormulaC9H7O6P
Molecular Mass241.998
SMILESO=c1ccc2cc(OP(=O)(O)O)ccc2o1
InChI KeyVENSWSIVZIIWRB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classcoumarins and derivatives
Subclass coumarins and derivatives
Direct Parent coumarins and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-benzopyrans
  • aryl phosphomonoesters
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactones
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • pyranones and derivatives
  • Substituents
  • benzopyran
  • 1-benzopyran
  • heteroaromatic compound
  • coumarin
  • lactone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • phosphoric acid ester
  • aromatic heteropolycyclic compound
  • pyran
  • pyranone
  • hydrocarbon derivative
  • aryl phosphomonoester
  • benzenoid
  • aryl phosphate
  • organic phosphoric acid derivative
  • organoheterocyclic compound
  • organooxygen compound