Mifepristone-d3

Analyte Name

Mifepristone-d3

Molecular Formula

C29 D3 H32 N O2

Molecular Weight

432.6122

Accurate Mass

432.2856

SMILES

[2H]C([2H])([2H])N(C)c1ccc(cc1)[C@H]2C[C@@]3(C)[C@@H](CC[C@@]3(O)C#CC)[C@@H]4CCC5=CC(=O)CCC5=C24

InChI

InChI=1S/C29H35NO2/c1-5-15-29(32)16-14-26-24-12-8-20-17-22(31)11-13-23(20)27(24)25(18-28(26,29)2)19-6-9-21(10-7-19)30(3)4/h6-7,9-10,17,24-26,32H,8,11-14,16,18H2,1-4H3/t24-,25+,26-,28-,29-/m0/s1/i3D3

IUPAC

(8S,11R,13S,14S,17S)-17-hydroxy-13-methyl-11-[4-[methyl(trideuteriomethyl)amino]phenyl]-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one

Unlabelled CAS Number

84371-65-3

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

API Family

Mifepristone

Purity

>95% (HPLC)