Analyte Name

Cyclic 17-(1,2-Ethanediyl Acetal) 3-(Acetyloxy)-androsta-3,5-dien-17-one-d9

Molecular Formula

C21H19D9O3

Molecular Weight

337.5

Accurate Mass

337.26

SMILES

C[C@@]12C(C([2H])([2H])C[C@@]1([H])[C@@]3([H])[C@]([C@@]4(C(C([2H])=C(C([2H])([2H])C4)OC(C([2H])([2H])[2H])=O)=C([2H])C3)C)([H])CC2)=O

InChI

InChI=1S/C21H28O3/c1-13(22)24-15-8-10-20(2)14(12-15)4-5-16-17-6-7-19(23)21(17,3)11-9-18(16)20/h4,12,16-18H,5-11H2,1-3H3/t16-,17-,18-,20-,21-/m0/s1/i1D3,4D,7D2,8D2,12D

IUPAC

(8R,9S,10R,13S,14S)-10,13-dimethyl-17-oxo-2,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl-2,2,4,6,16,16-d6 acetate-d3

Unlabelled CAS Number

70226-84-5

SIL Type

Deuterium

Storage Temperature

+20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat