Nombre del analito

3beta,7beta-Di-O-acetyl 24-Nor 3beta-Ursodeoxycholic Acid-d5 Methyl Ester

Fórmula molecular

C28 D5 H39 O6

Peso molecular

481.676

Masa exacta

481.345

SMILES

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

InChI

InChI=1S/C28H44O6/c1-16(13-25(31)32-6)21-7-8-22-26-23(10-12-28(21,22)5)27(4)11-9-20(33-17(2)29)14-19(27)15-24(26)34-18(3)30/h16,19-24,26H,7-15H2,1-6H3/t16-,19+,20+,21-,22+,23+,24+,26+,27+,28-/m1/s1/i9D2,14D2,20D

IUPAC

methyl (3R)-3-[(3S,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-diacetyloxy-2,2,3,4,4-pentadeuterio-10,13-dimethyl-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]butanoate

Tipo SIL

Deuterium

Temperatura de envío

Room Temperature

País de origen

CANADA

Formato del producto

Neat