(8xi,9xi,10xi,13xi,14xi)-17-hydroxy-3,11,20-trioxopregn-4-en-21-yl acetate
Chemical Structure Depiction of
(8xi,9xi,10xi,13xi,14xi)-17-hydroxy-3,11,20-trioxopregn-4-en-21-yl acetate
(8xi,9xi,10xi,13xi,14xi)-17-hydroxy-3,11,20-trioxopregn-4-en-21-yl acetate
Compound characteristics
| Compound ID: | N039-0026 |
| Compound Name: | (8xi,9xi,10xi,13xi,14xi)-17-hydroxy-3,11,20-trioxopregn-4-en-21-yl acetate |
| Molecular Weight: | 402.49 |
| Molecular Formula: | C23 H30 O6 |
| Smiles: | CC(=O)OCC([C@]1(CCC2C3CCC4=CC(CCC4(C)C3C(CC12C)=O)=O)O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1969 |
| logD: | 2.1969 |
| logSw: | -3.9797 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.633 |
| InChI Key: | ITRJWOMZKQRYTA-URPLTGPBSA-N |