Try beta.chemspider
- 12 of 15 defined stereocentres
(3beta,5xi,9xi,14beta,18xi,20beta)-3-[(6-Deoxy-2,3-O-isopropylidene-beta-D-allopyranosyl)oxy]urs-12-ene-27,28-dioic acid
C[C@H]1CC[C@@]2(CC[C@]3(C(=CCC4[C@]3(CCC5[C@@]4(CC[C@@H](C5(C)C)O[C@H]6[C@H]7[C@@H]([C@@H]([C@H](O6)C)O)OC(O7)(C)C)C)C)C2[C@H]1C)C(=O)O)C(=O)O
InChI=1S/C39H60O9/c1-20-12-17-38(32(41)42)18-19-39(33(43)44)23(27(38)21(20)2)10-11-25-36(8)15-14-26(34(4,5)24(36)13-16-37(25,39)9)46-31-30-29(28(40)22(3)45-31)47-35(6,7)48-30/h10,20-22,24-31,40H,11-19H2,1-9H3,(H,41,42)(H,43,44)/t20-,21-,22+,24?,25?,26-,27?,28+,29+,30+,31-,36-,37+,38-,39-/m0/s1
GBWAHGYHGHPMFW-LICKDUJKSA-N
CSID:4885106, http://www.chemspider.com/Chemical-Structure.4885106.html (accessed 04:06, Jul 4, 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