26403-11-2 (番泻苷C,Sennoside C)

快速询单

结构式：

番泻苷CMOL文件

CAS号：

26403-11-2

中文名称：

番泻苷C

英文名称：

Sennoside C

分子式：

C₄₂H₄₀O₁₉

分子量：

848.755614280701

番泻苷C(26403-11-2)名称与标识符

名称

中文别名：

番泻苷C;

英文别名：

Sennoside C;Q-100439;(9,9'-BIANTHRACENE)-2-CARBOXYLIC ACID, 5,5'-BIS(.BETA.-D-GLUCOPYRANOSYLOXY)-9,9',10,10'-TETRAHYDRO-4,4'-DIHYDROXY-2'-(HYDROXYMETHYL)-10,10'-DIOXO-, (9R,9'R)-REL-;(9,9'-Bianthracene)-2-carboxylic acid, 5,5'-bis(beta-D-glucopyranosyloxy)-9,9',10,10'-tetrahydro-4,4'-dihydroxy-2'-(hydroxymethyl)-10,10'-dioxo-, (R*,R*)-;26403-11-2;UNII-UQ166P8802;SENNOSIDE C (CONSTITUENT OF SENNA LEAF AND PODS) [DSC];37271-16-2;Sennoside-C;(9R)-4-hydroxy-9-[(9R)-4-hydroxy-2-(hydroxymethyl)-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracene-2-carboxylic acid;C16797;Q27149784;UQ166P8802;AKOS025287037;CHEBI:80734;

标识符

InChIKey：

ZFWOUNNKSHIAFK-RDAFFBQNSA-N

Inchi：

1S/C42H40O19/c43-11-14-7-18-26(16-3-1-5-22(30(16)34(50)28(18)20(46)8-14)58-41-38(54)36(52)32(48)24(12-44)60-41)27-17-4-2-6-23(59-42-39(55)37(53)33(49)25(13-45)61-42)31(17)35(51)29-19(27)9-15(40(56)57)10-21(29)47/h1-10,24-27,32-33,36-39,41-49,52-55H,11-13H2,(H,56,57)/t24-,25-,26-,27-,32-,33-,36+,37+,38-,39-,41-,42-/m1/s1

SMILES：

O(C1=CC=CC2=C1C(C1C(=CC(CO)=CC=1[C@@H]2[C@H]1C2C=C(C(=O)O)C=C(C=2C(C2C(=CC=CC1=2)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)=O)O)O)=O)[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O