Analyte Name

5alpha-Pregnan-3beta-ol-20-one 3beta-Acetate

CAS Number

906-83-2

Molecular Formula

C23 H36 O3

Molecular Weight

360.53

Accurate Mass

360.266

SMILES

CC(=O)O[C@H]1CCC2(C)[C@@H](CC[C@H]3[C@@H]4CC[C@H](C(=O)C)[C@@]4(C)CC[C@H]23)C1

InChI

InChI=1S/C23H36O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h16-21H,5-13H2,1-4H3/t16-,17-,18-,19+,20-,21-,22?,23+/m0/s1

IUPAC

[(3S,5S,8R,9S,13S,14S,17S)-17-acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat