Try beta.chemspider
- Charge
- 10 of 10 defined stereocentres
2-{[(3alpha,5alpha,8alpha,9beta,12alpha,17alpha,20S)-3,8,12-Trihydroxy-24-oxocholan-24-yl]amino}ethanesulfonate
[O-]S(=O)(=O)CCNC(=O)CC[C@@H]([C@@H]1CC[C@@H]3[C@]1(C)[C@@H](O)C[C@H]2[C@@]4([C@@H](CC[C@@]23O)C[C@H](O)CC4)C)C
InChI=1S/C26H45NO7S/c1-16(4-7-23(30)27-12-13-35(32,33)34)19-5-6-20-25(19,3)22(29)15-21-24(2)10-9-18(28)14-17(24)8-11-26(20,21)31/h16-22,28-29,31H,4-15H2,1-3H3,(H,27,30)(H,32,33,34)/p-1/t16-,17-,18+,19-,20+,21-,22-,24-,25+,26-/m0/s1
QZTRRTOMKSKXLP-UUBNHXFZSA-M
CSID:7780708, http://www.chemspider.com/Chemical-Structure.7780708.html (accessed 09:58, Apr 26, 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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