2-{[(3α,5β)-3-Hydroxy-24-oxocholan-24-yl]amino}ethyl hydrogen sulfate

More details:

• Systematic name

  2-{[(3alpha,5beta)-3-Hydroxy-24-oxocholan-24-yl]amino}ethyl hydrogen sulfate

• SMILES

  C[C@H](CCC(=O)NCCOS(=O)(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C

• Std. InChi

  InChI=1S/C26H45NO6S/c1-17(4-9-24(29)27-14-15-33-34(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

• Std. InChIKey

  OJVCMYFJVGLGLS-GBURMNQMSA-N

• Cite this record

  CSID:34250670, http://www.chemspider.com/Chemical-Structure.34250670.html (accessed 22:31, Apr 27, 2024)