(1β,3β,13ξ,16β,22S)-1-{[6-O-(β-D-Galactopyranosyl)-β-D-glucopyranosyl]oxy}-3,22-dihydroxycholest-5-en-16-yl β-D-glucopyranoside

More details:

• Systematic name

  (1beta,3beta,13xi,16beta,22S)-1-{[6-O-(beta-D-Galactopyranosyl)-beta-D-glucopyranosyl]oxy}-3,22-dihydroxycholest-5-en-16-yl beta-D-glucopyranoside

• SMILES

  C[C@@H]([C@H]1[C@H](C[C@@H]2C1(CC[C@H]3[C@H]2CC=C4[C@@]3([C@@H](C[C@@H](C4)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO[C@H]6[C@@H]([C@H]([C@H]([C@H](O6)CO)O)O)O)O)O)O)C)C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)[C@H](CCC(C)C)O

• Std. InChi

  InChI=1S/C45H76O19/c1-18(2)6-9-25(49)19(3)31-26(60-42-39(57)36(54)33(51)28(16-47)62-42)14-24-22-8-7-20-12-21(48)13-30(45(20,5)23(22)10-11-44(24,31)4)64-43-40(58)37(55)34(52)29(63-43)17-59-41-38(56)35(53)32(50)27(15-46)61-41/h7,18-19,21-43,46-58H,6,8-17H2,1-5H3/t19-,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+/m1/s1

• Std. InChIKey

  QWFYIWMOQSYCBY-XIVDTOQUSA-N

• Cite this record

  CSID:57641776, http://www.chemspider.com/Chemical-Structure.57641776.html (accessed 13:53, Apr 19, 2024)