Pregnane-3,20-dione, 5,6-dihydroxy-6,17-dimethyl-, (5alpha,6beta)-
(5R,6S,8S,9S,10R,13S,14S,17S)-17-acetyl-5,6-dihydroxy-6,10,13,17-tetramethyl-2,4,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: Pregnane-3,20-dione, 5,6-dihydroxy-6,17-dimethyl-, (5alpha,6beta)-|(5R,6S,8S,9S,10R,13S,14S,17S)-17-acetyl-5,6-dihydroxy-6,10,13,17-tetramethyl-2,4,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one|5,6alpha-Dihydroxy-6beta,17-dimethyl-5alpha-pregnane-3,20-dione|Pregnane-3,20-dione, 5,6-dihydroxy-6,17-dimethyl-, (5?,6ss)-|Pregnane-3,20-dione,5,6-dihydroxy-6,17-dimethyl-,(5alpha,6beta)|(5R,6S,8S,9S,10R,13S,14S,17S)-17-acetyl-5,6-dihydroxy-6,10,13,17-tetramethyl-2,4,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta(a)phenanthren-3-one
| Molecular Formula | C23H36O4 |
|---|---|
| Molecular Weight | 376.26135 g/mol |
| LogP | 3.6693 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 376.26135 |
| Monoisotopic Mass | 376.26135 |
| Heavy Atoms | 27 |
| Complexity | 698.49194 |
Chemical Identifiers
| CAS Number | 3577-69-3 |
|---|---|
| SMILES | CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@]([C@@]4([C@@]3(CCC(=O)C4)C)O)(C)O)C)C |
Product Overview
Pregnane-3,20-dione, 5,6-dihydroxy-6,17-dimethyl-, (5alpha,6beta)- (CAS 3577-69-3), with molecular formula C23H36O4 and molecular weight 376.26135 g/mol. IUPAC: (5R,6S,8S,9S,10R,13S,14S,17S)-17-acetyl-5,6-dihydroxy-6,10,13,17-tetramethyl-2,4,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one.