Chem
J-GLOBAL ID：200907056614544100   Nikkaji number：J1.943.613F

3′,4′,5,7-Tetrahydroxy-6-[6-O-(3-methoxy-4-hydroxy-trans-cinnamoyl)-β-D-glucopyranosyl]flavone

3′,4′,5,7-テトラヒドロキシ-6-[6-O-(3-メトキシ-4-ヒドロキシ-trans-シンナモイル)-β-D-グルコピラノシル]フラボン
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： C31H28O14
Molecular formula furigana： C31-H28-O14
Molecular weight： 624.551
InChI： InChI=1S/C31H28O14/c1-42-21-8-13(2-5-16(21)33)3-7-24(37)43-12-23-27(38)29(40)30(41)31(45-23)26-19(36)11-22-25(28(26)39)18(35)10-20(44-22)14-4-6-15(32)17(34)9-14/h2-11,23,27,29-34,36,38-41H,12H2,1H3/b7-3+/t23-,27-,29+,30-,31+/m1/s1
InChI key： BINSKANNELDDKD-NHKSLLPBSA-N
SMILES： COc1cc(/C=C/C(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H](O)[C@@H]2O)c2c(O)cc3oc(cc(=O)c3c2O)c2ccc(O)c(O)c2)ccc1O
Systematic name  (3)：
  • 3′,4′,5,7-テトラヒドロキシ-6-[6-O-(3-メトキシ-4-ヒドロキシ-trans-シンナモイル)-β-D-グルコピラノシル]フラボン
  • [(2R,3S,4R,5R,6S)-6-[2-(3,4-ジヒドロキシフェニル)-5,7-ジヒドロキシ-4-オキソ-4H-クロメン-6-イル]-3,4,5-トリヒドロキシオキサン-2-イル]メチル (2E)-3-(4-ヒドロキシ-3-メトキシフェニル)プロパ-2-エノアート
  • [(2R,3S,4R,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-6-yl]-3,4,5-trihydroxyoxan-2-yl]methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Other name (1)：
  • 3′,4′,5,7-Tetrahydroxy-6-[6-O-(3-methoxy-4-hydroxy-trans-cinnamoyl)-β-D-glucopyranosyl]flavone
Thsaurus map：
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