Chem
J-GLOBAL ID：200907066600881745   Nikkaji number：J419.756I

Daphnoretin

ダフノレチン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C19H12O7
Molecular formula furigana： C19-H12-O7
Molecular weight： 352.298
InChI： InChI=1S/C19H12O7/c1-23-16-6-11-7-17(19(22)26-15(11)9-13(16)20)24-12-4-2-10-3-5-18(21)25-14(10)8-12/h2-9,20H,1H3
InChI key： JRHMMVBOTXEHGJ-UHFFFAOYSA-N
SMILES： COc1cc2cc(Oc3ccc4ccc(=O)oc4c3)c(=O)oc2cc1O
Systematic name  (4)：
  • 7-ヒドロキシ-6-メトキシ-3-[(2-オキソ-2H-1-ベンゾピラン7-イル)-オキシ]-2H-1-ベンゾピラン-2-オン
  • 7-ヒドロキシ-6-メトキシ-[3,7′-オキシビス[2H-1-ベンゾピラン-2-オン]]
  • 7-ヒドロキシ-6-メトキシ-3-[(2-オキソ-2H-クロメン-7-イル)オキシ]-2H-クロメン-2-オン
  • 7-hydroxy-6-methoxy-3-[(2-oxo-2H-chromen-7-yl)oxy]-2H-chromen-2-one
Other name (5)：
  • ダフノレチン
  • Daphnoretin
  • 7-Hydroxy-6-methoxy-3-[(2-oxo-2H-1-benzopyran 7-yl)-oxy]-2H-1-benzopyran-2-one
  • Thymerol
  • 7-Hydroxy-6-methoxy-[3,7′-oxybis[2H-1-benzopyran-2-one]]
CAS registry number： 2034-69-7
KEGG COMPOUND： C09216
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