(3beta,6alpha)-17-(Acetyloxy)-3-hydroxy-6-methyl-pregn-4-en-20-one
[(3S,6S,8R,9S,10R,13S,14S,17R)-17-acetyl-3-hydroxy-6,10,13-trimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate
Also Known As: BL 141|BL-141|3-Hydroxy-6-alpha-methyl-17-acetoxyprogesterone|3-beta,17-Dihydroxy-6-alpha-methylpregn-4-en-20-one 17-acetate|(3beta,6alpha)-17-(acetyloxy)-3-hydroxy-6-methyl-pregn-4-en-20-one|Pregn-4-en-20-one, 17-(acetyloxy)-3-hydroxy-6-methyl-, (3-beta,6-alpha)-|Pregn-4-en-20-one, 3-beta,17-dihydroxy-6-alpha-methyl-, 17-acetate|pregn-4-en-20-one,3b,17-dihydroxy-6a-methyl-,17-acetate|3beta,17-Dihydroxy-6alpha-methylpregn-4-en-20-one 17-acetate|(3beta,6alpha)-3-hydroxy-6-methyl-20-oxopregn-4-en-17-yl acetate|(17-acetyl-3-hydroxy-6,10,13-trimethyl-1,2,3,6,7,8,9,11,12,1|[(3S,6S,8R,9S,10R,13S,14S,17R)-17-acetyl-3-hydroxy-6,10,13-trimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate|17-(Acetyloxy)-3-hydroxy-6-methyl-pregn-4-en-20-one, (3beta,6alpha)-|3.BETA.,17-DIHYDROXY-6.ALPHA.-METHYLPREGN-4-EN-20-ONE 17-ACETATE|17-(ACETYLOXY)-3-HYDROXY-6-METHYL-PREGN-4-EN-20-ONE, (3.BETA.,6.ALPHA.)-|Pregn-4-en-20-one, 17-(acetyloxy)-3-hydroxy-6-methyl-, (3-beta,6-alpha)- (9CI)|PREGN-4-EN-20-ONE, 17-(ACETYLOXY)-3-HYDROXY-6-METHYL-, (3.BETA.,6.ALPHA.)-|PREGN-4-EN-20-ONE, 3.BETA.,17-DIHYDROXY-6.ALPHA.-METHYL-, 17-ACETATE|(17-acetyl-3-hydroxy-6,10,13-trimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl) acetate|(1R,3aS,3bR,5S,7S,9aR,9bS,11aS)-1-acetyl-7-hydroxy-5,9a,11a-trimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl acetate
| Molecular Formula | C24H36O4 |
|---|---|
| Molecular Weight | 388.26135 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 388.26135 |
| Monoisotopic Mass | 388.26135 |
| Heavy Atoms | 28 |
| Complexity | 726.0 |
Chemical Identifiers
| CAS Number | 57-16-9 |
|---|---|
| SMILES | C[C@H]1C[C@@H]2[C@H](CC[C@]3([C@H]2CC[C@@]3(C(=O)C)OC(=O)C)C)[C@@]4(C1=C[C@H](CC4)O)C |
| InChIKey | ODVZWAWQENIRKD-CKRBXLRKSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3beta,6alpha)-17-(Acetyloxy)-3-hydroxy-6-methyl-pregn-4-en-20-one (CAS 57-16-9), with molecular formula C24H36O4 and molecular weight 388.26135 g/mol. IUPAC: [(3S,6S,8R,9S,10R,13S,14S,17R)-17-acetyl-3-hydroxy-6,10,13-trimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate.