Analyte Name

(17alpha)-Cyclic 3-(1,2-Ethanediyl Acetal) 17-(Acetyloxy)-17-(1-oxopropyl)-estra-5(10),9(11)-dien-3-one

CAS Number

153363-57-6

Molecular Formula

C25 H34 O5

Molecular Weight

414.534

Accurate Mass

414.241

SMILES

CCC(=O)[C@]1(CC[C@H]2[C@@H]3CCC4=C(CCC5(C4)OCCO5)C3=CC[C@]12C)OC(=O)C

InChI

InChI=1S/C25H34O5/c1-4-22(27)25(30-16(2)26)12-9-21-20-6-5-17-15-24(28-13-14-29-24)11-8-18(17)19(20)7-10-23(21,25)3/h7,20-21H,4-6,8-15H2,1-3H3/t20-,21+,23+,25+/m1/s1

IUPAC

[(8S,13S,14S,17R)-13-methyl-17-propanoylspiro[1,2,4,6,7,8,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-yl] acetate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat