21-Acetyl-17,21-dihydroxy-pregna-4,8-diene-3,11,20-trione

Analyte Name

21-Acetyl-17,21-dihydroxy-pregna-4,8-diene-3,11,20-trione

CAS Number

1856-26-4

Molecular Formula

C23 H28 O6

Molecular Weight

400.465

Accurate Mass

400.189

SMILES

CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2C3=C(C(=O)C[C@]12C)[C@@]4(C)CCC(=O)C=C4CC3

InChI

InChI=1S/C23H28O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h10,17,28H,4-9,11-12H2,1-3H3/t17-,21-,22-,23-/m0/s1

IUPAC

[2-[(10S,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-1,2,6,7,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Purity

>95% (HPLC)