5-alpha-Pregnane-11,20-dione, 3-alpha-hydroxy-16-alpha-methyl-2-beta-morpholino-
(2S,3S,5S,8S,9S,10S,13S,14S,16R,17S)-17-acetyl-3-hydroxy-10,13,16-trimethyl-2-morpholin-4-yl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one
Also Known As: 3-alpha-Hydroxy-16-alpha-methyl-2-beta-morpholino-5-alpha-pregnane-11,20-dione|5-alpha-Pregnane-11,20-dione, 3-alpha-hydroxy-16-alpha-methyl-2-beta-morpholino-|3-Hydroxy-16-methyl-2-(morpholin-4-yl)pregnane-11,20-dione|3alpha-Hydroxy-16alpha-methyl-2beta-(morpholin-4-yl)-5alpha-pregnane-11,20-dione|(2S,3S,5S,8S,9S,10S,13S,14S,16R,17S)-17-acetyl-3-hydroxy-10,13,16-trimethyl-2-morpholin-4-yl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one
| Molecular Formula | C26H41NO4 |
|---|---|
| Molecular Weight | 431.30356 g/mol |
| LogP | 3.33 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 431.30356 |
| Heavy Atoms | 31 |
| Complexity | 747.7 |
Chemical Identifiers
| CAS Number | 52-91-5 |
|---|---|
| SMILES | C[C@@H]1C[C@H]2[C@@H]3CC[C@H]4C[C@@H]([C@H](C[C@@]4([C@H]3C(=O)C[C@@]2([C@H]1C(=O)C)C)C)N5CCOCC5)O |
Product Overview
5-alpha-Pregnane-11,20-dione, 3-alpha-hydroxy-16-alpha-methyl-2-beta-morpholino- (CAS 52-91-5), with molecular formula C26H41NO4 and molecular weight 431.30356 g/mol. IUPAC: (2S,3S,5S,8S,9S,10S,13S,14S,16R,17S)-17-acetyl-3-hydroxy-10,13,16-trimethyl-2-morpholin-4-yl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one.
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