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

More details:

• Systematic name

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

• SMILES

  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](OC2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[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]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

• Std. InChi

  InChI=1S/C56H90O33/c1-19-11-55-9-5-26-53(2,7-4-8-54(26,3)52(77)88-50-44(86-48-40(75)36(71)30(65)22(14-59)80-48)42(32(67)24(16-61)82-50)84-46-38(73)34(69)28(63)20(12-57)78-46)27(55)6-10-56(19,18-55)89-51-45(87-49-41(76)37(72)31(66)23(15-60)81-49)43(33(68)25(17-62)83-51)85-47-39(74)35(70)29(64)21(13-58)79-47/h20-51,57-76H,1,4-18H2,2-3H3/t20-,21-,22-,23-,24-,25-,26+,27+,28-,29-,30-,31-,32-,33-,34+,35+,36+,37+,38-,39-,40-,41-,42+,43+,44-,45-,46+,47?,48+,49+,50+,51+,53-,54-,55-,56+/m1/s1

• Std. InChIKey

  GSGVXNMGMKBGQU-DXORWINZSA-N

• Cite this record

  CSID:82964025, http://www.chemspider.com/Chemical-Structure.82964025.html (accessed 18:51, May 21, 2024)