HuagongsheHuagongshe Chemistry Print Report · For research reference only
3beta-Benzoyloxy-5alpha-cholest-8(14)-ene-7,15-dione
Identifiers & Physical Properties
| Molecular formula | C34H46O4 |
|---|---|
| Average molar mass | 518.7 g/mol |
| SMILES | CC(C)CCC[C@@H](C)[C@H]1CC(=O)C2=C3C(=O)C[C@H]4C[C@@H](OC(=O)c5ccccc5)CC[C@]4(C)[C@H]3CC[C@@]21C |
| InChIKey | SRBSJSVHCDUPHP-LYBSOTFYSA-N |
| PubChem CID | 67640468 |
Chemical & Physical Properties
| XLogP | 8.4 |
|---|---|
| Topological polar surface area | 60.4 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 8 |
| Heavy atoms | 38 |
| Formal charge | 0 |
| Complexity | 971 |