Try beta.chemspider
- 4 of 10 defined stereocentres
2-{[(5beta,9xi,14xi,17xi,20xi)-3,6-Dihydroxy-24-oxocholan-24-yl]amino}ethanesulfonic acid
CC(CCC(=O)NCCS(=O)(=O)O)C1CCC2[C@@]1(CCC3[C@H]2CC([C@H]4[C@@]3(CCC(C4)O)C)O)C
InChI=1S/C26H45NO6S/c1-16(4-7-24(30)27-12-13-34(31,32)33)19-5-6-20-18-15-23(29)22-14-17(28)8-10-26(22,3)21(18)9-11-25(19,20)2/h16-23,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33)/t16?,17?,18-,19?,20?,21?,22-,23?,25+,26+/m0/s1
HMXPOCDLAFAFNT-GREZAIHCSA-N
CSID:29788110, http://www.chemspider.com/Chemical-Structure.29788110.html (accessed 17:32, May 16, 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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