Analyte Name

3-Methoxy-7beta-methyl-6beta-(phenylsulfonyl) Estradiol

CAS Number

156137-95-0

Molecular Formula

C26H32O4S

Molecular Weight

440.59

Accurate Mass

440.2021

SMILES

COc1ccc2[C@H]3CC[C@]4(C)[C@@H](O)CC[C@H]4[C@@H]3[C@@H](C)[C@H](c2c1)S(=O)(=O)c5ccccc5

InChI

InChI=1S/C26H32O4S/c1-16-24-20(13-14-26(2)22(24)11-12-23(26)27)19-10-9-17(30-3)15-21(19)25(16)31(28,29)18-7-5-4-6-8-18/h4-10,15-16,20,22-25,27H,11-14H2,1-3H3/t16-,20-,22+,23+,24-,25-,26+/m1/s1

IUPAC

(6R,7R,8R,9S,13S,14S,17S)-6-(benzenesulfonyl)-3-methoxy-7,13-dimethyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat