Try beta.chemspider
- 9 of 9 defined stereocentres
- Non-standard isotope
2-{[(3alpha,5beta,13alpha)-3-Hydroxy-24-oxo(2,2,3,4,4-~2~H_5_)cholan-24-yl]amino}ethanesulfonic acid
[2H][C@]1(O)C([2H])([2H])[C@H]2CC[C@H]3[C@@H]4CC[C@H]([C@H](C)CCC(=O)NCCS(O)(=O)=O)[C@]4(C)CC[C@@H]3[C@@]2(C)CC1([2H])[2H]
InChI=1S/C26H45NO5S/c1-17(4-9-24(29)27-14-15-33(30,31)32)21-7-8-22-20-6-5-18-16-19(28)10-12-25(18,2)23(20)11-13-26(21,22)3/h17-23,28H,4-16H2,1-3H3,(H,27,29)(H,30,31,32)/t17-,18-,19-,20+,21-,22+,23+,25+,26+/m1/s1/i10D2,16D2,19D
QBYUNVOYXHFVKC-BXNXNIOXSA-N
CSID:114392261, http://www.chemspider.com/Chemical-Structure.114392261.html (accessed 22:30, 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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