3,9-dihydroxy-17-oxoestra-1,3,5(10)-trien-11-yl acetate
Chemical Structure Depiction of
3,9-dihydroxy-17-oxoestra-1,3,5(10)-trien-11-yl acetate
3,9-dihydroxy-17-oxoestra-1,3,5(10)-trien-11-yl acetate
Compound characteristics
| Compound ID: | 3529-0042 |
| Compound Name: | 3,9-dihydroxy-17-oxoestra-1,3,5(10)-trien-11-yl acetate |
| Molecular Weight: | 344.41 |
| Molecular Formula: | C20 H24 O5 |
| Smiles: | [H]C12CCC(C1(C)CC(C1(c3ccc(cc3CCC12[H])O)O)OC(C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9767 |
| logD: | 1.9765 |
| logSw: | -3.4857 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.244 |
| InChI Key: | ZICCHKPCKNVBPQ-UHFFFAOYSA-N |