Try beta.chemspider
- 22 of 22 defined stereocentres
(3alpha,5beta,8alpha,9beta,10alpha,14beta,17alpha,18alpha)-3-{[6-Deoxy-alpha-D-mannopyranosyl-(1->2)-[beta-L-glucopyranosyl-(1->4)]-alpha-D-arabinopyranosyl]oxy}-27-hydroxyolean-12-en-28-oic acid
C[C@H]1O[C@H](O[C@@H]2[C@@H](O[C@@H]3CC[C@@]4(C)[C@@H]5CC=C6[C@H]7CC(C)(C)CC[C@]7(CC[C@]6(CO)[C@@]5(C)CC[C@@H]4C3(C)C)C(O)=O)OC[C@@H](O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O
InChI=1S/C47H76O17/c1-22-30(50)33(53)35(55)38(60-22)64-37-32(52)26(62-39-36(56)34(54)31(51)25(19-48)61-39)20-59-40(37)63-29-11-12-44(6)27(43(29,4)5)10-13-45(7)28(44)9-8-23-24-18-42(2,3)14-15-46(24,41(57)58)16-17-47(23,45)21-49/h8,22,24-40,48-56H,9-21H2,1-7H3,(H,57,58)/t22-,24-,25+,26-,27-,28+,29-,30-,31+,32-,33+,34-,35+,36+,37+,38-,39-,40-,44-,45+,46-,47-/m1/s1
RNHLYDFRRIHVAM-SMHUUFJSSA-N
CSID:82964570, http://www.chemspider.com/Chemical-Structure.82964570.html (accessed 04:50, Jun 1, 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
Advertisement
Spotlight