Analyte Name

9(11)-Epoxide Hydrocortisone Acetate

CAS Number

4383-30-6

Molecular Formula

C23H30O6

Molecular Weight

402.48

Accurate Mass

402.2

SMILES

C[C@@]12[C@@]34[C@@](C[C@]5([C@](CC[C@]5(O)C(COC(C)=O)=O)([H])[C@]4([H])CCC1=CC(CC2)=O)C)([H])O3

InChI

InChI=1S/C23H30O6/c1-13(24)28-12-18(26)22(27)9-7-16-17-5-4-14-10-15(25)6-8-20(14,2)23(17)19(29-23)11-21(16,22)3/h10,16-17,19,27H,4-9,11-12H2,1-3H3/t16-,17-,19-,20-,21-,22-,23+/m0/s1

IUPAC

2-((4aS,4bS,5aS,6aS,7R,9aS,9bS)-7-hydroxy-4a,6a-dimethyl-2-oxo-2,3,4,4a,5a,6,6a,7,8,9,9a,9b,10,11-tetradecahydrocyclopenta[1,2]phenanthro[4,4a-b]oxiren-7-yl)-2-oxoethyl acetate

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat