Base information
| Cat. No. | |
| CAS No. | 63958-90-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C33H54N12O15 |
| Molecular Weight | 858.853 |
| Exact Mass | 858.383 |
| XLogP3 | -3.6779 |
| Mr | 202.179 |
| PSA | 451.86 |
| Sequence | - |
| Atom number | 114 |
| Bond number | 114 |
| Ring number | 1 |
| Rotor number | 36 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)CO)CCC(=O)N)CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1)C |
