11,21-Dihydroxy-3,20-dioxopregna-1,4-dien-17-yl pentanoate
[11-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] pentanoate
Also Known As: PREDNIVAL, Prednival [USAN], Prednisolone 17-valerate, EINECS 239-228-2, W 4869, 11,21-dihydroxy-3,20-dioxopregna-1,4-dien-17-yl pentanoate, 11-beta,17-21-Trihydroxypregna-1,4-diene-3,20-dione 17-valerate, 11beta,17,21-Trihydroxypregna-1,4-diene-3,20-dione 17-valerate, Pregna-1,4-diene-3,20-dione, 11-beta,17,21-trihydroxy-, 17-valerate, Pregna-1,4-diene-3,20-dione, 11,21-dihydroxy-17-((1-oxopentyl)oxy)-, (11beta)-, [(8S,9R,10R,11S,13S,14S,17R)-11-Hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[A, [11-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] pentanoate
| Molecular Formula | C26H36O6 |
|---|---|
| Molecular Weight | 444.2512 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 100.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.2512 |
| Heavy Atoms | 32 |
| Complexity | 873 |
Chemical Identifiers
| CAS Number | 15180-00-4 |
|---|---|
| SMILES | CCCCC(=O)OC1(CCC2C1(CC(C3C2CCC4=CC(=O)C=CC34C)O)C)C(=O)CO |
Product Overview
11,21-Dihydroxy-3,20-dioxopregna-1,4-dien-17-yl pentanoate (CAS 15180-00-4), with molecular formula C26H36O6 and molecular weight 444.2512 g/mol. IUPAC: [11-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] pentanoate.
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