Try beta.chemspider
- 25 of 25 defined stereocentres
1-O-[(2alpha,3alpha,5beta,8alpha,9beta,10alpha,14beta,17alpha,18alpha)-3-{[4-O-(beta-L-Glucopyranosyl)-beta-L-xylopyranosyl]oxy}-2,24-dihydroxy-29-methoxy-28,29-dioxoolean-12-en-28-yl]-beta-L-glucopyr anose
COC(=O)[C@@]1(C)C[C@@H]2C3=CC[C@H]4[C@]5(C)C[C@@H](O)[C@@H](O[C@H]6OC[C@H](O[C@H]7O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]7O)[C@@H](O)[C@@H]6O)[C@](C)(CO)[C@H]5CC[C@]4(C)[C@@]3(C)CC[C@@]2(CC1)C(=O)O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O
InChI=1S/C48H76O21/c1-43(41(61)63-6)11-13-48(42(62)69-40-36(60)33(57)30(54)25(18-50)66-40)14-12-46(4)21(22(48)15-43)7-8-28-44(2)16-23(52)37(45(3,20-51)27(44)9-10-47(28,46)5)68-38-34(58)31(55)26(19-64-38)67-39-35(59)32(56)29(53)24(17-49)65-39/h7,22-40,49-60H,8-20H2,1-6H3/t22-,23-,24+,25+,26+,27+,28+,29+,30+,31-,32-,33-,34+,35+,36+,37-,38-,39-,40-,43-,44-,45-,46+,47+,48-/m1/s1
UQCUBQIHIKJPHI-YEXHJLKASA-N
CSID:82964577, http://www.chemspider.com/Chemical-Structure.82964577.html (accessed 22:43, May 9, 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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