HuagongsheHuagongshe Chemistry Print Report · For research reference only
Hydroxybersamagenin 1,5-orthoacetate
Identifiers & Physical Properties
| CAS No. | 35609-28-0 |
|---|---|
| Molecular formula | C26H34O7 |
| Average molar mass | 458.5 g/mol |
| Monoisotopic mass | 458.23045342 g/mol |
| SMILES | CC12OC3CC(O1)C1(C)C4CCC5(C)C(c6ccc(=O)oc6)C(O)CC5(O)C4CCC1(C3)O2 |
| InChIKey | OBJNGSFPVMJDQZ-UHFFFAOYSA-N |
| PubChem CID | 317841 |
| DTXSID | DTXSID60312237 |
Chemical & Physical Properties
| XLogP | 2.1 |
|---|---|
| Topological polar surface area | 94.5 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 7 |
| Rotatable bonds | 1 |
| Heavy atoms | 33 |
| Formal charge | 0 |
| Complexity | 991 |