Base information
| Cat. No. | |
| CAS No. | 12704-90-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C44H62N2O12 |
| Molecular Weight | 810.969 |
| Exact Mass | 810.43 |
| XLogP3 | 3.4761 |
| Mr | 221.531 |
| PSA | 217.24 |
| Sequence | - |
| Atom number | 120 |
| Bond number | 122 |
| Ring number | 3 |
| Rotor number | 18 |
| Residues number | 0 |
| Canonical smiles | C/C=C\C=C\[C@@H]1O[C@](O)([C@@H](C(=O)NC/C=C/C=C(/[C@H]([C@H]([C@@H]2O[C@@H]([C@@H]([C@@H]2O)O)/C=C/C=C/C=C(/C(=O)c2c(O)ccn(c2=O)C)\C)C)OC)\C)CC)[C@@H]([C@@H](C1(C)C)O)O |
