Nombre del analito

(3alpha,5beta)-3-[(Ethoxycarbonyl)oxy]-7-oxo-cholan-24-oic Acid Methyl Ester

Número CAS

96475-64-8

Fórmula molecular

C28H44O6

Peso molecular

476.65

Masa exacta

476.3138

SMILES

CCOC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](C1)CC(=O)[C@H]3[C@@H]4CC[C@H]([C@H](C)CCC(=O)OC)[C@@]4(C)CC[C@H]23

InChI

InChI=1S/C28H44O6/c1-6-33-26(31)34-19-11-13-27(3)18(15-19)16-23(29)25-21-9-8-20(17(2)7-10-24(30)32-5)28(21,4)14-12-22(25)27/h17-22,25H,6-16H2,1-5H3/t17-,18+,19-,20-,21+,22+,25+,27+,28-/m1/s1

IUPAC

methyl (4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-ethoxycarbonyloxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate

Temperatura de envío

Room Temperature

País de origen

CANADA

Tipo de producto

API

Formato del producto

Neat