2-O-β-D-Glucopyranosyl-1-O-(13-{[2-O-(β-D-glucopyranosyl)-β-D-glucopyranosyl]oxy}-18-oxokaur-16-en-18-yl)-β-D-glucopyranose

More details:

• Systematic name

  2-O-beta-D-Glucopyranosyl-1-O-(13-{[2-O-(beta-D-glucopyranosyl)-beta-D-glucopyranosyl]oxy}-18-oxokaur-16-en-18-yl)-beta-D-glucopyranose

• SMILES

  [H][C@@]12CC[C@@]3(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C[C@]2(CC[C@@]6([H])[C@](C)(C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)CCC[C@@]61C)CC3=C C[C@]12CCC[C@](C)([C@@H]1CC[C@]13CC(=C)[C@](C1)(CC[C@H]23)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

• Std. InChi

  InChI=1S/C44H70O23/c1-17-11-43-9-5-22-41(2,7-4-8-42(22,3)40(59)66-38-34(30(55)26(51)20(14-47)62-38)64-36-32(57)28(53)24(49)18(12-45)60-36)23(43)6-10-44(17,16-43)67-39-35(31(56)27(52)21(15-48)63-39)65-37-33(58)29(54)25(50)19(13-46)61-37/h18-39,45-58H,1,4-16H2,2-3H3/t18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28+,29+,30+,31+,32-,33-,34-,35-,36+,37+,38+,39+,41+,42-,43+,44-/m1/s1

• Std. InChIKey

  RLLCWNUIHGPAJY-ITNJYIBCSA-N

• Cite this record

  CSID:73993238, http://www.chemspider.com/Chemical-Structure.73993238.html (accessed 22:48, Apr 19, 2024)