Analyte Name

3-O-Methyl-6-oxo 17beta-Estradiol

CAS Number

50731-96-9

Molecular Formula

C19H24O3

Molecular Weight

300.39

Accurate Mass

300.1725

SMILES

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

InChI

InChI=1S/C19H24O3/c1-19-8-7-13-12-4-3-11(22-2)9-15(12)17(20)10-14(13)16(19)5-6-18(19)21/h3-4,9,13-14,16,18,21H,5-8,10H2,1-2H3/t13-,14-,16+,18+,19+/m1/s1

IUPAC

(8R,9S,13S,14S,17S)-17-hydroxy-3-methoxy-13-methyl-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-6-one

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API

Product Format

Neat