Chem
J-GLOBAL ID：200907054734794840   Nikkaji number：J2.257.773E

(E)-3-[6-O-(3,5-Dimethoxy-4-hydroxybenzoyl)-β-D-glucopyranosyloxy]stilbene-4′,5-diol

(E)-3-[6-O-(3,5-ジメトキシ-4-ヒドロキシベンゾイル)-β-D-グルコピラノシルオキシ]スチルベン-4′,5-ジオール
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： C29H30O12
Molecular formula furigana： C29-H30-O12
Molecular weight： 570.547
InChI： InChI=1S/C29H30O12/c1-37-21-11-17(12-22(38-2)24(21)32)28(36)39-14-23-25(33)26(34)27(35)29(41-23)40-20-10-16(9-19(31)13-20)4-3-15-5-7-18(30)8-6-15/h3-13,23,25-27,29-35H,14H2,1-2H3/b4-3+/t23-,25-,26+,27-,29-/m1/s1
InChI key： SARSZJDBDZHKQN-IOAVGLNOSA-N
SMILES： COc1cc(cc(OC)c1O)C(=O)OC[C@H]1O[C@@H](Oc2cc(O)cc(/C=C/c3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3)：
  • (E)-3-[6-O-(3,5-ジメトキシ-4-ヒドロキシベンゾイル)-β-D-グルコピラノシルオキシ]スチルベン-4′,5-ジオール
  • [(2R,3S,4S,5R,6S)-3,4,5-トリヒドロキシ-6-{3-ヒドロキシ-5-[(1E)-2-(4-ヒドロキシフェニル)エテニル]フェノキシ}オキサン-2-イル]メチル 4-ヒドロキシ-3,5-ジメトキシベンゾアート
  • [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-{3-hydroxy-5-[(1E)-2-(4-hydroxyphenyl)ethenyl]phenoxy}oxan-2-yl]methyl 4-hydroxy-3,5-dimethoxybenzoate
Other name (1)：
  • (E)-3-[6-O-(3,5-Dimethoxy-4-hydroxybenzoyl)-β-D-glucopyranosyloxy]stilbene-4′,5-diol
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