Try beta.chemspider
- 23 of 23 defined stereocentres
1-O-[(3alpha,5beta,8alpha,9beta,10alpha,14beta,17alpha,18alpha)-3-{[2-O-(beta-L-Glucopyranosyl)-beta-L-glucopyranuronosyl]oxy}-28-oxoolean-12-en-28-yl]-beta-L-glucopyranose
C[C@]12CC[C@@]3(CCC(C)(C)C[C@@H]3C1=CC[C@@H]1[C@]2(C)CC[C@H]2[C@@]1(C)CC[C@@H](O[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O)C(O)=O)C2(C)C)C(=O)O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O
InChI=1S/C48H76O19/c1-43(2)14-16-48(42(61)67-40-35(58)31(54)29(52)24(20-50)63-40)17-15-46(6)21(22(48)18-43)8-9-26-45(5)12-11-27(44(3,4)25(45)10-13-47(26,46)7)64-41-37(33(56)32(55)36(65-41)38(59)60)66-39-34(57)30(53)28(51)23(19-49)62-39/h8,22-37,39-41,49-58H,9-20H2,1-7H3,(H,59,60)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31-,32-,33-,34+,35+,36-,37+,39-,40-,41+,45-,46+,47+,48-/m1/s1
NFZYDZXHKFHPGA-FMSCIEADSA-N
CSID:82964569, http://www.chemspider.com/Chemical-Structure.82964569.html (accessed 04:32, May 21, 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