Try beta.chemspider
- 29 of 29 defined stereocentres
(3beta,16beta)-16,23,28-Trihydroxyoleana-9(11),12-dien-3-yl 6-deoxy-alpha-D-mannopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->3)-[beta-D-glucopyranosyl-(1->2)]-6-deoxy-beta-D-galactopyranoside
C[C@H]1O[C@@H]([C@H]([C@H]([C@@H]1O)O)O)O[C@H]2[C@@H]([C@H]([C@@H](O[C@@H]2CO)O[C@@H]3[C@H]([C@@H](O[C@@H]([C@@H]3O)C)O[C@@H]4[C@]([C@H]5[C@@](C6=CC=C7[C@]([C@@]6(CC5)C)(C[C@@H]([C@@]8([C@H]7C[C@](CC8)(C)C)CO)O)C)(CC4)C)(CO)C)O[C@@H]9O[C@@H]([C@H]([C@@H]([C@H]9O)O)O)CO)O)O
InChI=1S/C54H88O22/c1-23-33(60)36(63)39(66)45(69-23)74-42-28(20-56)72-47(41(68)38(42)65)75-43-34(61)24(2)70-48(44(43)76-46-40(67)37(64)35(62)27(19-55)71-46)73-32-12-13-50(5)29(51(32,6)21-57)11-14-52(7)30(50)10-9-25-26-17-49(3,4)15-16-54(26,22-58)31(59)18-53(25,52)8/h9-10,23-24,26-29,31-48,55-68H,11-22H2,1-8H3/t23-,24-,26+,27-,28-,29-,31+,32+,33-,34+,35-,36+,37+,38-,39+,40-,41-,42-,43+,44-,45-,46+,47+,48+,50+,51+,52-,53-,54-/m1/s1
NWQQCEBYZYQXIQ-FGSHCMKGSA-N
CSID:10232892, http://www.chemspider.com/Chemical-Structure.10232892.html (accessed 07:34, May 29, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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