Chem
J-GLOBAL ID：200907056398452211
Nikkaji number：J1.992.926D
2β,5β-Bis(4-hydroxyphenyl)-3β,4α-bis[2,3-dihydro-6-hydroxy-2β-(4-hydroxyphenyl)-3α-(3,5-dihydroxyphenyl)benzofuran-4-yl]tetrahydrofuran
2β,5β-ビス(4-ヒドロキシフェニル)-3β,4α-ビス[2,3-ジヒドロ-6-ヒドロキシ-2β-(4-ヒドロキシフェニル)-3α-(3,5-ジヒドロキシフェニル)ベンゾフラン-4-イル]テトラヒドロフラン
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
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
Molecular formula： C56H44O13
Molecular formula furigana： C56-H44-O13
Molecular weight： 924.955
InChI：
InChI=1S/C56H44O13/c57-33-9-1-27(2-10-33)53-47(31-17-37(61)21-38(62)18-31)49-43(23-41(65)25-45(49)67-53)51-52(56(30-7-15-36(60)16-8-30)69-55(51)29-5-13-35(59)14-6-29)44-24-42(66)26-46-50(44)48(32-19-39(63)22-40(64)20-32)54(68-46)28-3-11-34(58)12-4-28/h1-26,47-48,51-66H/t47-,48-,51+,52+,53+,54+,55-,56+/m1/s1
InChI key：
DPXIUIZIRAPRIE-ZDSRRIDGSA-N
SMILES：
Oc1ccc(cc1)[C@H]1O[C@H]([C@H]([C@@H]1c1cc(O)cc2O[C@H]([C@@H](c12)c1cc(O)cc(O)c1)c1ccc(O)cc1)c1cc(O)cc2O[C@H]([C@@H](c12)c1cc(O)cc(O)c1)c1ccc(O)cc1)c1ccc(O)cc1
Systematic name (4)：
- 2β,5β-ビス(4-ヒドロキシフェニル)-3β,4α-ビス[2,3-ジヒドロ-6-ヒドロキシ-2β-(4-ヒドロキシフェニル)-3α-(3,5-ジヒドロキシフェニル)ベンゾフラン-4-イル]テトラヒドロフラン
- 4,4′-[(2S,3R,4R,5R)-2,5-ビス(4-ヒドロキシフェニル)テトラヒドロフラン-3,4-ジイル]ビス[(2R,3R)-2-(4-ヒドロキシフェニル)-3-(3,5-ジヒドロキシフェニル)-2,3-ジヒドロベンゾフラン-6-オール]
- 5-[(2R,3R)-4-[(2S,3R,4R,5R)-4-[(2R,3R)-3-(3,5-ジヒドロキシフェニル)-6-ヒドロキシ-2-(4-ヒドロキシフェニル)-2,3-ジヒドロ-1-ベンゾフラン-4-イル]-2,5-ビス(4-ヒドロキシフェニル)オキソラン-3-イル]-6-ヒドロキシ-2-(4-ヒドロキシフェニル)-2,3-ジヒドロ-1-ベンゾフラン-3-イル]ベンゼン-1,3-ジオール
- 5-[(2R,3R)-4-[(2S,3R,4R,5R)-4-[(2R,3R)-3-(3,5-dihydroxyphenyl)-6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-4-yl]-2,5-bis(4-hydroxyphenyl)oxolan-3-yl]-6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol
- 2β,5β-Bis(4-hydroxyphenyl)-3β,4α-bis[2,3-dihydro-6-hydroxy-2β-(4-hydroxyphenyl)-3α-(3,5-dihydroxyphenyl)benzofuran-4-yl]tetrahydrofuran
- 4,4′-[(2S,3R,4R,5R)-2,5-Bis(4-hydroxyphenyl)tetrahydrofuran-3,4-diyl]bis[(2R,3R)-2-(4-hydroxyphenyl)-3-(3,5-dihydroxyphenyl)-2,3-dihydrobenzofuran-6-ol]
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