17-Oxo-1,3,5(10)-triene-3,16alpha-diol diacetate structure

17-Oxo-1,3,5(10)-triene-3,16alpha-diol diacetate

[(8R,9S,13S,14S,16R)-3-acetyloxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl] acetate

Also Known As: Colpormon|Colpogynon|hydroxyestrone diacetate|Estriol Impurity 19|Estradiol Impurity 21|COLPORMON [MI]|16alpha-Hydroxyestron-diacetat|EINECS 214-997-7|16 alpha-hydroxyestrone diacetate|RD-310|16B-HYDROXYESTRONE DIACETATE|HYDROXYESTRONE DIACETATE [WHO-DD]|3,16alpha-Dihydroxyestra-1,3,5(10)-trien-17-one 3,16-diacetate|16.ALPHA.-HYDROXYESTRONE 3,16-DIACETATE|3,16-diacetoxy-1,3,5(10)-estratrien-17-one|17-Oxo-1,3,5(10)-triene-3,16alpha-diol diacetate|3,16alpha-Bis(acetyloxy)estra-1,3,5(10)-trien-17-one|[(8R,9S,13S,14S,16R)-3-acetyloxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl] acetate|17-Oxo-16alpha-estra-1(10),2,4-triene-3,16-diyl diacetate|3,16alpha-dihydroxyestra-1,3,5(10)-trien-17-one diacetate|Estra-1,3,5(10)-trien-17-one, 3,16-bis(acetyloxy)-, (16.alpha.)-|(16 alpha)-3,16-bis(acetyloxy)estra-1,3,5(10)-trien-17-one|(16-alpha)-3,16-Bis(acetyloxy)estra-1,3,5(10)-trien-17-one|(16alpha)-3,16-Bis(acetyloxy)estra-1,3,5(10)-trien-17-one|17-OXO-1,3,5(10)-TRIENE-3,16.ALPHA.-DIYL DIACETATE|Estra-1,3,5(10)-trien-17-one, 3,16.alpha.-dihydroxy-, diacetate|(2R,3aS,3bR,9bS,11aS)-7-(acetyloxy)-11a-methyl-1-oxo-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-2-yl acetate|(8R,9S,13S,14S,16R)-13-Methyl-17-oxo-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,16-diyl diacetate|[(8R,9S,13S,14S,16S)-3-acetyloxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl]acetate

CAS: 1247-71-8
Molecular Formula C22H26O5
Molecular Weight 370.178 g/mol
LogP 3.58
Topological Polar Surface Area 69.67 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 2
Exact Mass 370.178
Heavy Atoms 27
Complexity 812.9

Chemical Identifiers

CAS Number 1247-71-8
SMILES CC(=O)O[C@@H]1C[C@H]2[C@@H]3CCC4=C([C@H]3CC[C@@]2(C1=O)C)C=CC(=C4)OC(=O)C

Product Overview

17-Oxo-1,3,5(10)-triene-3,16alpha-diol diacetate (CAS 1247-71-8), with molecular formula C22H26O5 and molecular weight 370.178 g/mol. IUPAC: [(8R,9S,13S,14S,16R)-3-acetyloxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl] acetate.

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