Analyte Name

5beta-Estrane-3,17-dione

CAS Number

5696-51-5

Molecular Formula

C18H26O2

Molecular Weight

274.4

Accurate Mass

274.1933

SMILES

C[C@]12CC[C@@H]3[C@H]4CCC(=O)C[C@H]4CC[C@H]3[C@@H]1CCC2=O

InChI

InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h11,13-16H,2-10H2,1H3/t11-,13+,14-,15-,16+,18+/m1/s1

IUPAC

(5R,8R,9R,10S,13S,14S)-13-methyl-1,2,4,5,6,7,8,9,10,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-dione

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat