Try beta.chemspider
- Double-bond stereo
- 14 of 14 defined stereocentres
(2S,4R,9beta,16alpha,23E)-16,20,25-Trihydroxy-9,10,14-trimethyl-1,11,22-trioxo-4,9-cyclo-9,10-secocholesta-5,23-dien-2-yl beta-D-glucopyranoside
C[C@]1(C(=O)[C@H](C[C@@H]2C1=CC[C@@H]3[C@]2(C(=O)C[C@]4([C@]3(C[C@H]([C@@H]4[C@@](O)(C(=O)/C=C/C(O)(C)C)C)O)C)C)C)O[C@@H]5O[C@@H]([C@H]([C@@H]([C@H]5O)O)O)CO)C
InChI=1S/C36H54O12/c1-31(2,45)12-11-23(39)36(8,46)28-19(38)14-33(5)22-10-9-17-18(35(22,7)24(40)15-34(28,33)6)13-20(29(44)32(17,3)4)47-30-27(43)26(42)25(41)21(16-37)48-30/h9,11-12,18-22,25-28,30,37-38,41-43,45-46H,10,13-16H2,1-8H3/b12-11+/t18-,19-,20+,21-,22+,25-,26+,27-,28+,30-,33+,34-,35+,36+/m1/s1
GOWXUGYRPHOTEQ-QYNXQQORSA-N
CSID:10191803, http://www.chemspider.com/Chemical-Structure.10191803.html (accessed 02:38, Jul 5, 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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