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- 10 of 13 defined stereocentres
(3beta,5xi,9xi,18xi)-28-Hydroxy-28-oxoolean-12-en-3-yl beta-D-allopyranosiduronic acid
C[C@]12CC[C@@H](C(C1CC[C@@]3(C2CC=C4[C@]3(CC[C@@]5(C4CC(CC5)(C)C)C(=O)O)C)C)(C)C)O[C@H]6[C@@H]([C@@H]([C@@H]([C@H](O6)C(=O)O)O)O)O
InChI=1S/C36H56O9/c1-31(2)14-16-36(30(42)43)17-15-34(6)19(20(36)18-31)8-9-22-33(5)12-11-23(32(3,4)21(33)10-13-35(22,34)7)44-29-26(39)24(37)25(38)27(45-29)28(40)41/h8,20-27,29,37-39H,9-18H2,1-7H3,(H,40,41)(H,42,43)/t20?,21?,22?,23-,24+,25-,26+,27-,29+,33-,34+,35+,36-/m0/s1
IUCHKMAZAWJNBJ-BNCFNKJYSA-N
CSID:4884791, http://www.chemspider.com/Chemical-Structure.4884791.html (accessed 04:39, 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
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