rel-(8xi,10xi,13xi,14xi)-9-fluoro-17-methyl-3,20-dioxopregna-1,4-diene-11,16,21-triyl tripropanoate
Chemical Structure Depiction of
rel-(8xi,10xi,13xi,14xi)-9-fluoro-17-methyl-3,20-dioxopregna-1,4-diene-11,16,21-triyl tripropanoate
rel-(8xi,10xi,13xi,14xi)-9-fluoro-17-methyl-3,20-dioxopregna-1,4-diene-11,16,21-triyl tripropanoate
Compound characteristics
| Compound ID: | 8004-7656 |
| Compound Name: | rel-(8xi,10xi,13xi,14xi)-9-fluoro-17-methyl-3,20-dioxopregna-1,4-diene-11,16,21-triyl tripropanoate |
| Molecular Weight: | 560.66 |
| Molecular Formula: | C31 H41 F O8 |
| Smiles: | CCC(=O)OCC([C@@]1(C)[C@@H](CC2C3CCC4=CC(C=CC4(C)[C@]3(C(CC12C)OC(CC)=O)F)=O)OC(CC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0255 |
| logD: | 5.0255 |
| logSw: | -5.0191 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 86.712 |
| InChI Key: | NPKLZMKETIIPBI-JYUSAIKJSA-N |