Analyte Name

17beta-Hydroxyestr-4-en-3-one-d3 Cyclic Ethylene Acetal

Molecular Formula

C20 D3 H27 O3

Molecular Weight

321.469

Accurate Mass

321.238

SMILES

[2H]C1([2H])C[C@H]2[C@@H]3CCC4=CC5(CC[C@@H]4[C@H]3CC[C@]2(C)[C@@]1([2H])O)OCCO5

InChI

InChI=1S/C20H30O3/c1-19-8-6-15-14-7-9-20(22-10-11-23-20)12-13(14)2-3-16(15)17(19)4-5-18(19)21/h12,14-18,21H,2-11H2,1H3/t14-,15+,16+,17-,18-,19-/m0/s1/i5D2,18D

IUPAC

(8'R,9'S,10'R,13'S,14'S,17'S)-16',16',17'-trideuterio-13'-methylspiro[1,3-dioxolane-2,3'-2,6,7,8,9,10,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthrene]-17'-ol

Unlabelled CAS Number

13886-12-9

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity; Stable Isotope Labelled

Product Format

Neat