(3α)-11-Oxo-3-[(N-phenylglycyl)oxy]urs-12-en-24-oic acid

More details:

• Systematic name

  (3alpha)-11-Oxo-3-[(N-phenylglycyl)oxy]urs-12-en-24-oic acid

• SMILES

  C[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CC(=O)[C@H]3[C@@](C)(CC[C@H]4[C@](C)([C@@H](CC[C@@]43C)OC(=O)CNC3C=CC=CC=3)C(O)=O)[C@]1(C)CC2

• Std. InChi

  InChI=1S/C38H53NO5/c1-23-13-16-34(3)19-20-36(5)26(31(34)24(23)2)21-27(40)32-35(4)17-15-29(44-30(41)22-39-25-11-9-8-10-12-25)38(7,33(42)43)28(35)14-18-37(32,36)6/h8-12,21,23-24,28-29,31-32,39H,13-20,22H2,1-7H3,(H,42,43)/t23-,24+,28-,29-,31+,32-,34-,35+,36-,37-,38-/m1/s1

• Std. InChIKey

  FGADXOKGDHDYCV-KZCHHNOYSA-N

• Cite this record

  CSID:90660297, http://www.chemspider.com/Chemical-Structure.90660297.html (accessed 20:01, May 21, 2024)