Chem
J-GLOBAL ID：200907000976331761   Nikkaji number：J2.277.785H

2-(4-Hydroxyphenyl)-5,7-dihydroxy-6-[2-O-(β-D-xylopyranosyl)-β-D-glucopyranosyl]-4H-1-benzopyran-4-one

2-(4-ヒドロキシフェニル)-5,7-ジヒドロキシ-6-[2-O-(β-D-キシロピラノシル)-β-D-グルコピラノシル]-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： C26H28O14
Molecular formula furigana： C26-H28-O14
Molecular weight： 564.496
InChI： InChI=1S/C26H28O14/c27-7-16-20(33)22(35)25(40-26-23(36)19(32)13(31)8-37-26)24(39-16)18-12(30)6-15-17(21(18)34)11(29)5-14(38-15)9-1-3-10(28)4-2-9/h1-6,13,16,19-20,22-28,30-36H,7-8H2/t13-,16-,19+,20-,22+,23-,24+,25-,26+/m1/s1
InChI key： ACRIYYKEWCXQOS-XLUFPDOKSA-N
SMILES： OC[C@H]1O[C@H]([C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O)c1c(O)cc2oc(cc(=O)c2c1O)c1ccc(O)cc1
Systematic name  (3)：
  • 2-(4-ヒドロキシフェニル)-5,7-ジヒドロキシ-6-[2-O-(β-D-キシロピラノシル)-β-D-グルコピラノシル]-4H-1-ベンゾピラン-4-オン
  • 6-[(2S,3R,4S,5S,6R)-4,5-ジヒドロキシ-6-(ヒドロキシメチル)-3-{[(2S,3R,4S,5R)-3,4,5-トリヒドロキシオキサン-2-イル]オキシ}オキサン-2-イル]-5,7-ジヒドロキシ-2-(4-ヒドロキシフェニル)-4H-クロメン-4-オン
  • 6-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one
Other name (1)：
  • 2-(4-Hydroxyphenyl)-5,7-dihydroxy-6-[2-O-(β-D-xylopyranosyl)-β-D-glucopyranosyl]-4H-1-benzopyran-4-one
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