Base information
| Cat. No. | |
| CAS No. | 145525-41-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C38H50CaN2O7 |
| Molecular Weight | 686.891 |
| Exact Mass | 686.324 |
| XLogP3 | 5.5945 |
| Mr | 187.254 |
| PSA | 102.45 |
| Sequence | - |
| Atom number | 98 |
| Bond number | 102 |
| Ring number | 6 |
| Rotor number | 14 |
| Residues number | 0 |
| Canonical smiles | O=C(C(CC(=O)N1C[C@@H]2[C@H](C1)CCCC2)Cc1ccccc1)O[Ca]OC(=O)C(CC(=O)N1C[C@@H]2[C@H](C1)CCCC2)Cc1ccccc1.O |
