Base information
| Cat. No. | |
| CAS No. | 865-21-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C46H58N4O9 |
| Molecular Weight | 810.974 |
| Exact Mass | 810.42 |
| XLogP3 | 3.9317 |
| Mr | 232.524 |
| PSA | 154.1 |
| Sequence | - |
| Atom number | 117 |
| Bond number | 125 |
| Ring number | 9 |
| Rotor number | 10 |
| Residues number | 0 |
| Canonical smiles | COc1cc2N(C)[C@@H]3[C@@]4(c2cc1[C@]1(C[C@H]2C[N@@](CCc5c1[nH]c1c5cccc1)C[C@](C2)(O)CC)C(=O)OC)CCN1[C@H]4[C@@]([C@H]([C@]3(O)C(=O)OC)OC(=O)C)(CC)C=CC1 |
