rel-(8xi,9xi,14xi)-17-hydroxypregna-4,6-diene-3,20-dione
Chemical Structure Depiction of
rel-(8xi,9xi,14xi)-17-hydroxypregna-4,6-diene-3,20-dione
rel-(8xi,9xi,14xi)-17-hydroxypregna-4,6-diene-3,20-dione
Compound characteristics
| Compound ID: | 8014-9888 |
| Compound Name: | rel-(8xi,9xi,14xi)-17-hydroxypregna-4,6-diene-3,20-dione |
| Molecular Weight: | 328.45 |
| Molecular Formula: | C21 H28 O3 |
| Smiles: | CC([C@]1(CCC2C3C=CC4=CC(CC[C@]4(C)C3CC[C@]12C)=O)O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4947 |
| logD: | 2.4947 |
| logSw: | -3.8466 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.734 |
| InChI Key: | JBVNBBXAMBZTMQ-PLSWVNJZSA-N |