Analyte Name

3-Deshydroxy-3-methoxy Estrone-D3

Molecular Formula

C19 D3 H23 O2

Molecular Weight

289.427

Accurate Mass

289.212

SMILES

[2H]C([2H])([2H])OC1=CCC2=C(CC[C@@H]3[C@@H]2CC[C@@]4(C)[C@H]3CCC4=O)C1

InChI

InChI=1S/C19H26O2/c1-19-10-9-15-14-6-4-13(21-2)11-12(14)3-5-16(15)17(19)7-8-18(19)20/h4,15-17H,3,5-11H2,1-2H3/t15-,16-,17+,19+/m1/s1/i2D3

IUPAC

(8R,9S,13S,14S)-13-methyl-3-(trideuteriomethoxy)-4,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-one

Unlabelled CAS Number

17976-32-8

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat