Chem
J-GLOBAL ID:200907082511716892   Nikkaji number:J725.991C

(2R,2′R)-2α,2′α-Bis(3,4-dihydroxyphenyl)-3α-(galloyloxy)-4β,8′-bichroman-3′β,5,5′,7,7′-pentol

(2R,2′R)-2α,2′α-ビス(3,4-ジヒドロキシフェニル)-3α-(ガロイルオキシ)-4β,8′-ビクロマン-3′β,5,5′,7,7′-ペンタオール
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: C37H30O16
Molecular formula furigana: C37-H30-O16
Molecular weight: 730.631
InChI: InChI=1S/C37H30O16/c38-16-9-23(44)29-28(10-16)51-34(14-2-4-19(40)22(43)6-14)36(53-37(50)15-7-25(46)32(49)26(47)8-15)31(29)30-24(45)12-20(41)17-11-27(48)33(52-35(17)30)13-1-3-18(39)21(42)5-13/h1-10,12,27,31,33-34,36,38-49H,11H2/t27-,31+,33+,34+,36+/m0/s1
InChI key: BXWABJPTCUDBMM-NNJCKQBNSA-N
SMILES: O[C@H]1Cc2c(O)cc(O)c([C@@H]3[C@@H](OC(=O)c4cc(O)c(O)c(O)c4)[C@H](Oc4cc(O)cc(O)c34)c3ccc(O)c(O)c3)c2O[C@@H]1c1ccc(O)c(O)c1
Systematic name  (3):
  • (2R,2′R)-2α,2′α-ビス(3,4-ジヒドロキシフェニル)-3α-(ガロイルオキシ)-4β,8′-ビクロマン-3′β,5,5′,7,7′-ペンタオール
  • (2R,3R,4R)-2-(3,4-ジヒドロキシフェニル)-4-[(2R,3S)-2-(3,4-ジヒドロキシフェニル)-3,5,7-トリヒドロキシ-3,4-ジヒドロ-2H-1-ベンゾピラン-8-イル]-5,7-ジヒドロキシ-3,4-ジヒドロ-2H-1-ベンゾピラン-3-イル 3,4,5-トリヒドロキシベンゾアート
  • (2R,3R,4R)-2-(3,4-dihydroxyphenyl)-4-[(2R,3S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-8-yl]-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate
Other name (1):
  • (2R,2′R)-2α,2′α-Bis(3,4-dihydroxyphenyl)-3α-(galloyloxy)-4β,8′-bichroman-3′β,5,5′,7,7′-pentol
Thsaurus map:

Return to Previous Page