(11Beta)​-11-​Hydroxy-​17,​20:20,​21-​bis[methylenebis(oxy​)​]-pregna-​1,​4-​dien-​3-​one-d8

Analyte Name

(11beta)-11-Hydroxy-17,20:20,21-bis[methylenebis(oxy)]-pregna-1,4-dien-3-one-d8

Molecular Formula

C23H22D8O6

Molecular Weight

410.53

Accurate Mass

410.25

SMILES

C[C@@]12C(C([2H])([2H])C[C@]3([H])[C@]2([2H])[C@](O)([2H])C([2H])([2H])[C@@]4(C)[C@]3(CC[C@@]45OCOC56COCO6)[H])=C([2H])C(C([2H])=C1)=O

InChI

InChI=1S/C23H30O6/c1-20-7-5-15(24)9-14(20)3-4-16-17-6-8-22(21(17,2)10-18(25)19(16)20)23(29-13-27-22)11-26-12-28-23/h5,7,9,16-19,25H,3-4,6,8,10-13H2,1-2H3/t16-,17-,18-,19+,20-,21-,22+,23?/m0/s1/i3D2,5D,9D,10D2,18D,19D

IUPAC

(8S,9S,10R,11S,13S,14S,17R)-11-hydroxy-10,13-dimethyl-7,8,9,10,11,12,13,14,15,16-decahydrodispiro[cyclopenta[a]phenanthrene-17,4'-[1,3]dioxolane-5',4''-[1,3]dioxolan]-3(6H)-one-2,4,6,6,9,11,12,12-d8

Unlabelled CAS Number

6874-19-7

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat