Base information
| Cat. No. | |
| CAS No. | 761443-02-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C35H48N12O12 |
| Molecular Weight | 828.829 |
| Exact Mass | 828.351 |
| XLogP3 | 3.3397 |
| Mr | 212.178 |
| PSA | 376.48 |
| Sequence | - |
| Atom number | 107 |
| Bond number | 108 |
| Ring number | 2 |
| Rotor number | 30 |
| Residues number | 0 |
| Canonical smiles | O=C(N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])C)C)CCCCNC(=O)C)C)CNC(=O)c1ccccc1N |
