(3β,5ξ,9ξ,18ξ)-19,28-Dihydroxy-28-oxoolean-12-en-3-yl 4-O-β-D-xylopyranosyl-β-D-glucopyranosiduronic acid

SMILES:

CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(C(O6)C(=O)O)OC7C(C(C(CO7)O)O)O)O)O)C)C)C2C1O)C)C(=O)O)C CopyCopied

Std. InChI:

InChI=1S/C41H64O14/c1-36(2)14-16-41(35(50)51)17-15-39(6)19(24(41)31(36)47)8-9-22-38(5)12-11-23(37(3,4)21(38)10-13-40(22,39)7)53-34-28(46)26(44)29(30(55-34)32(48)49)54-33-27(45)25(43)20(42)18-52-33/h8,20-31,33-34,42-47H,9-18H2,1-7H3,(H,48,49)(H,50,51)/t20-,21?,22?,23+,24?,25+,26-,27-,28-,29+,30+,31?,33+,34-,38+,39-,40-,41+/m1/s1 CopyCopied

Std. InChIKey:

MQBKACDMFLVGJA-QQHPQGJESA-N CopyCopied

CSID:22913099, http://www.chemspider.com/Chemical-Structure.22913099.html (accessed 02:18, May 22, 2013) CopyCopied