| CAS Number | 517904-33-5 |
| Catalog Number | AG00362J(AGN-PC-0SB8XD) |
| Chemical Name | Glycine, N-[(3α,5β,7α,12α)-3,7,12-trihydroxy-24-oxocholan-24-yl]-, ethyl ester |
| IUPAC Name | ethyl 2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]acetate |
| InChI | InChI=1S/C28H47NO6/c1-5-35-25(34)15-29-24(33)9-6-16(2)19-7-8-20-26-21(14-23(32)28(19,20)4)27(3)11-10-18(30)12-17(27)13-22(26)31/h16-23,26,30-32H,5-15H2,1-4H3,(H,29,33)/t16-,17+,18-,19-,20+,21+,22-,23+,26+,27+,28-/m1/s1 |
| InChI Key | IUMZSPQFQUFAHS-VVHBOOHCSA-N |
| MDL Number | MFCD30342207 |
| Molecular Formula | C28H47NO6 |
| Molecular Weight | 493.6759 |
| SMILES | O[C@H]1C[C@H]2C[C@H]([C@H]3[C@@H]4CC[C@H]([C@@H](CCC(=O)NCC(=O)OCC)C)[C@]4([C@H](C[C@@H]3[C@]2(CC1)C)O)C)O |
| Synonyms | Glycocholic acid ethyl ester,
517904-33-5,
MFCD30342207,
AKOS027321841,
|