Base information
| Cat. No. | |
| CAS No. | 477284-32-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C39H52N12O12 |
| Molecular Weight | 880.903 |
| Exact Mass | 880.383 |
| XLogP3 | 0.0622 |
| Mr | 219.635 |
| PSA | 406.26 |
| Sequence | - |
| Atom number | 115 |
| Bond number | 117 |
| Ring number | 3 |
| Rotor number | 33 |
| Residues number | 0 |
| Canonical smiles | OC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)N)CCCNC(=N)N)Cc1nc[nH]c1)CC(=O)O |
