9-hydroxy-11,17-dioxoestra-1,3,5(10)-trien-3-yl acetate
Chemical Structure Depiction of
9-hydroxy-11,17-dioxoestra-1,3,5(10)-trien-3-yl acetate
9-hydroxy-11,17-dioxoestra-1,3,5(10)-trien-3-yl acetate
Compound characteristics
| Compound ID: | 3529-0058 |
| Compound Name: | 9-hydroxy-11,17-dioxoestra-1,3,5(10)-trien-3-yl acetate |
| Molecular Weight: | 342.39 |
| Molecular Formula: | C20 H22 O5 |
| Smiles: | [H]C12CCC(C1(C)CC(C1(c3ccc(cc3CCC12[H])OC(C)=O)O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.6266 |
| logD: | 1.6266 |
| logSw: | -3.3255 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.418 |
| InChI Key: | WGTQVGSFKYPGLA-UHFFFAOYSA-N |