Chem
J-GLOBAL ID：201107060269816687   Nikkaji number：J2.982.775C

(2R)-7-(β-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-2,3-dihydro-4H-1-benzopyran-4-one

(2R)-7-(β-D-グルコピラノシルオキシ)-5-ヒドロキシ-2-(4-ヒドロキシ-3,5-ジメトキシフェニル)-2,3-ジヒドロ-4H-1-ベンゾピラン-4-オン
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： C23H26O12
Molecular formula furigana： C23-H26-O12
Molecular weight： 494.449
InChI： InChI=1S/C23H26O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-6,13,17,20-25,27-30H,7-8H2,1-2H3/t13-,17-,20-,21+,22-,23-/m1/s1
InChI key： LBWGQXPDFQTDCS-DZPXBWEGSA-N
SMILES： COc1cc(cc(OC)c1O)[C@H]1CC(=O)c2c(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2O1
Systematic name  (3)：
  • (2R)-7-(β-D-グルコピラノシルオキシ)-5-ヒドロキシ-2-(4-ヒドロキシ-3,5-ジメトキシフェニル)-2,3-ジヒドロ-4H-1-ベンゾピラン-4-オン
  • (2R)-5-ヒドロキシ-2-(4-ヒドロキシ-3,5-ジメトキシフェニル)-7-{[(2S,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}-3,4-ジヒドロ-2H-1-ベンゾピラン-4-オン
  • (2R)-5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-one
Other name (1)：
  • (2R)-7-(β-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-2,3-dihydro-4H-1-benzopyran-4-one
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