11-(Nitrooxy)-3,20-dioxopregna-1,4-dien-17-yl propanoate
(17-acetyl-10,13-dimethyl-11-nitrooxy-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl) propanoate
Also Known As: EINECS 245-416-5|11-(nitrooxy)-3,20-dioxopregna-1,4-dien-17-yl propanoate|(17-acetyl-10,13-dimethyl-11-nitrooxy-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl) propanoate|11|A,17-dihydroxypregna-1,4-diene-3,20-dione 11-nitrate 17-propionate|11beta,17-Dihydroxypregna-1,4-diene-3,20-dione 11-nitrate 17-propionate|Propionic acid (10R,11S,13S,17R)-17-acetyl-10,13-dimethyl-11-nitrooxy-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl ester
| Molecular Formula | C24H31NO7 |
|---|---|
| Molecular Weight | 445.21005 g/mol |
| LogP | 3.76 |
| Topological Polar Surface Area | 112.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 445.21005 |
| Heavy Atoms | 32 |
| Complexity | 938.6 |
Chemical Identifiers
| CAS Number | 23074-99-9 |
|---|---|
| SMILES | CCC(=O)OC1(CCC2C1(CC(C3C2CCC4=CC(=O)C=CC34C)O[N+](=O)[O-])C)C(=O)C |
Product Overview
11-(Nitrooxy)-3,20-dioxopregna-1,4-dien-17-yl propanoate (CAS 23074-99-9), with molecular formula C24H31NO7 and molecular weight 445.21005 g/mol. IUPAC: (17-acetyl-10,13-dimethyl-11-nitrooxy-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl) propanoate.
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