1-O-[(5β,8α,9β,10α,13α)-13-{[β-D-Glucopyranosyl-(1->2)-β-D-glucopyranosyl-(1->3)-β-D-glucopyranosyl]oxy}-18-oxokaur-16-en-18-yl]-β-D-gulopyranose

More details:

• Systematic name

  1-O-[(5beta,8alpha,9beta,10alpha,13alpha)-13-{[beta-D-Glucopyranosyl-(1->2)-beta-D-glucopyranosyl-(1->3)-beta-D-glucopyranosyl]oxy}-18-oxokaur-16-en-18-yl]-beta-D-gulopyranose

• SMILES

  C[C@@]12CCC[C@@]([C@H]1CC[C@]34[C@H]2CC[C@](C3)(C(=C)C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)(C)C(=O)O[C@H]8[C@@H]([C@@H]([C@H]([C@H](O8)CO)O)O)O

• Std. InChi

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

  NLSIFOOJILMUEI-KJUJJNEISA-N

• Cite this record

  CSID:26944081, http://www.chemspider.com/Chemical-Structure.26944081.html (accessed 23:29, Apr 16, 2024)