2-O-(6-Deoxy-β-D-glucopyranosyl)-1-O-[(5β,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-glucop yranose

More details:

• Systematic name

  2-O-(6-Deoxy-beta-D-glucopyranosyl)-1-O-[(5beta,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-glucop yranose

• SMILES

  C[C@H]1O[C@@H](O[C@H]2[C@H](OC(=O)[C@]3(C)CCC[C@@]4(C)[C@@H]5CC[C@@]6(CC5(CC6=C)CC[C@@H]43)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H]3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O

• Std. InChi

  InChI=1S/C50H80O27/c1-18-12-49-10-6-24-47(3,8-5-9-48(24,4)46(67)76-44-39(34(63)29(58)22(15-53)71-44)74-41-35(64)31(60)26(55)19(2)68-41)25(49)7-11-50(18,17-49)77-45-40(75-43-37(66)33(62)28(57)21(14-52)70-43)38(30(59)23(16-54)72-45)73-42-36(65)32(61)27(56)20(13-51)69-42/h19-45,51-66H,1,5-17H2,2-4H3/t19-,20-,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+,47-,48-,49?,50+/m1/s1

• Std. InChIKey

  HINSNOJRHFIMKB-LJQFGQLYSA-N

• Cite this record

  CSID:82964034, http://www.chemspider.com/Chemical-Structure.82964034.html (accessed 23:25, May 11, 2024)