N-[(3α,5β,7α,12α)-3,7,12-Trihydroxy-24-oxocholan-24-yl]glycyl-N-[2-(1H-imidazol-5-yl)ethyl]glycinamide

More details:

• Systematic name

  N-[(3alpha,5beta,7alpha,12alpha)-3,7,12-Trihydroxy-24-oxocholan-24-yl]glycyl-N-[2-(1H-imidazol-5-yl)ethyl]glycinamide

• SMILES

  C[C@H](CCC(=O)NCC(=O)NCC(=O)NCCc1cnc[nH]1)[C@H]2CC[C@@H]3[C@@]2([C@H](C[C@H]4[C@H]3[C@@H](C[C@H]5[C@@]4(CC[C@H](C5)O)C)O)O)C

• Std. InChi

  InChI=1S/C33H53N5O6/c1-19(4-7-28(42)36-17-30(44)37-16-29(43)35-11-9-21-15-34-18-38-21)23-5-6-24-31-25(14-27(41)33(23,24)3)32(2)10-8-22(39)12-20(32)13-26(31)40/h15,18-20,22-27,31,39-41H,4-14,16-17H2,1-3H3,(H,34,38)(H,35,43)(H,36,42)(H,37,44)/t19-,20+,22-,23-,24+,25+,26-,27+,31+,32+,33-/m1/s1

• Std. InChIKey

  CYMOQRVLVAJWLY-DXUXSUHXSA-N

• Cite this record

  CSID:112746, http://www.chemspider.com/Chemical-Structure.112746.html (accessed 05:01, Apr 19, 2024)