Try beta.chemspider
- 11 of 11 defined stereocentres
2-{[(3alpha,5beta,7alpha,9beta,11alpha)-3,7,11-Trihydroxy-24-oxocholan-24-yl]amino}ethanesulfonic acid
O=S(=O)(O)CCNC(=O)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)C[C@@H](O)[C@@H]4[C@H]2[C@H](O)C[C@@H]3C[C@H](O)CC[C@@]34C)C
InChI=1S/C26H45NO7S/c1-15(4-7-22(31)27-10-11-35(32,33)34)18-5-6-19-23-20(29)13-16-12-17(28)8-9-25(16,2)24(23)21(30)14-26(18,19)3/h15-21,23-24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34)/t15-,16+,17-,18-,19+,20-,21-,23-,24-,25+,26-/m1/s1
UQBKHQGSYUOEDU-WJCYTHPDSA-N
CSID:8919760, http://www.chemspider.com/Chemical-Structure.8919760.html (accessed 22:16, Apr 28, 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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