Chem
J-GLOBAL ID：200907003615036098   Nikkaji number：J1.638.806H

3,4′,5-Trihydroxystilbene-4-yl 6-O-galloyl-β-D-glucopyranoside

3,4′,5-トリヒドロキシスチルベン-4-イル6-O-ガロイル-β-D-グルコピラノシド
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： C27H26O13
Molecular formula furigana： C27-H26-O13
Molecular weight： 558.492
InChI： InChI=1S/C27H26O13/c28-15-5-3-12(4-6-15)1-2-13-7-18(31)25(19(32)8-13)40-27-24(36)23(35)22(34)20(39-27)11-38-26(37)14-9-16(29)21(33)17(30)10-14/h1-10,20,22-24,27-36H,11H2/t20-,22-,23+,24-,27+/m1/s1
InChI key： MEFPIYOWLGQGSN-KTXQOAOTSA-N
SMILES： O[C@@H]1[C@@H](COC(=O)c2cc(O)c(O)c(O)c2)O[C@@H](Oc2c(O)cc(C=Cc3ccc(O)cc3)cc2O)[C@H](O)[C@H]1O
Systematic name  (3)：
  • 3,4′,5-トリヒドロキシスチルベン-4-イル6-O-ガロイル-β-D-グルコピラノシド
  • [(2R,3S,4S,5R,6S)-6-{2,6-ジヒドロキシ-4-[2-(4-ヒドロキシフェニル)エテニル]フェノキシ}-3,4,5-トリヒドロキシオキサン-2-イル]メチル 3,4,5-トリヒドロキシベンゾアート
  • [(2R,3S,4S,5R,6S)-6-{2,6-dihydroxy-4-[2-(4-hydroxyphenyl)ethenyl]phenoxy}-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate
Other name (1)：
  • 3,4′,5-Trihydroxystilbene-4-yl 6-O-galloyl-β-D-glucopyranoside
Thsaurus map：
Thesaurus Map

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