(3β,22β)-22,24-Dihydroxyolean-12-en-3-yl 6-deoxy-α-L-idopyranosyl-(1->2)-β-D-galactopyranosyl-(1->2)-β-D-glucopyranosiduronate

SMILES:

[O-]C(=O)[C@H]8O[C@@H](O[C@H]4CC[C@]3(C)[C@H]5C/C=C2/[C@@H]1CC(C)(C)C[C@@H](O)[C@]1(C)CC[C@@]2(C)[C@]5(C)CC[C@H]3[C@@]4(C)CO)[C@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O)[C@H]7O[C@@H]6O[C@H]([C@@H](O)[C@H](O)[C@H]6O)C)[C@@H](O)[C@@H]8O CopyCopied

Std. InChI:

InChI=1S/C48H78O18/c1-21-29(52)31(54)35(58)40(61-21)65-37-32(55)30(53)24(19-49)62-41(37)66-38-34(57)33(56)36(39(59)60)64-42(38)63-28-12-13-45(5)25(46(28,6)20-50)11-14-48(8)26(45)10-9-22-23-17-43(2,3)18-27(51)44(23,4)15-16-47(22,48)7/h9,21,23-38,40-42,49-58H,10-20H2,1-8H3,(H,59,60)/p-1/t21-,23-,24+,25+,26+,27+,28-,29+,30-,31-,32-,33-,34-,35+,36-,37+,38+,40-,41-,42+,44+,45-,46+,47+,48+/m0/s1 CopyCopied

Std. InChIKey:

PTDAHAWQAGSZDD-VSAYGNTNSA-M CopyCopied

CSID:164742, http://www.chemspider.com/Chemical-Structure.164742.html (accessed 16:21, May 24, 2012) CopyCopied