Analyte Name

3,17-Dihydroxy-6-methyl-pregna-3,5-dien-20-one Diacetate

CAS Number

986-96-9

Molecular Formula

C26H36O5

Molecular Weight

428.56

Accurate Mass

428.2563

SMILES

CC(=O)OC1=CC2=C(C)C[C@@H]3[C@H](CC[C@@]4(C)[C@H]3CC[C@]4(OC(=O)C)C(=O)C)[C@@]2(C)CC1

InChI

InChI=1S/C26H36O5/c1-15-13-20-21(24(5)10-7-19(14-23(15)24)30-17(3)28)8-11-25(6)22(20)9-12-26(25,16(2)27)31-18(4)29/h14,20-22H,7-13H2,1-6H3/t20-,21+,22+,24-,25+,26+/m1/s1

IUPAC

[(8R,9S,10R,13S,14S,17R)-17-acetyl-17-acetyloxy-6,10,13-trimethyl-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-yl] acetate

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat