rel-(10xi,13xi,14xi,16xi,17xi)-8xi,9xi-spirostan-3-yl acetate
Chemical Structure Depiction of
rel-(10xi,13xi,14xi,16xi,17xi)-8xi,9xi-spirostan-3-yl acetate
rel-(10xi,13xi,14xi,16xi,17xi)-8xi,9xi-spirostan-3-yl acetate
Compound characteristics
| Compound ID: | N039-0023 |
| Compound Name: | rel-(10xi,13xi,14xi,16xi,17xi)-8xi,9xi-spirostan-3-yl acetate |
| Molecular Weight: | 458.68 |
| Molecular Formula: | C29 H46 O4 |
| Smiles: | CC1CC[C@@]2([C@@H](C)C3C(CC4C5CCC6CC(CCC6(C)C5CCC34C)OC(C)=O)O2)OC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.3879 |
| logD: | 6.3879 |
| logSw: | -6.2523 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.431 |
| InChI Key: | LVRAKYNQYKVPIK-NQUJENBJSA-N |