Base information
| Cat. No. | |
| CAS No. | 81156-93-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C64H106N22O21 |
| Molecular Weight | 1519.66 |
| Exact Mass | 1518.79 |
| XLogP3 | 1.9055 |
| Mr | 380.544 |
| PSA | 730.35 |
| Sequence | - |
| Atom number | 213 |
| Bond number | 213 |
| Ring number | 1 |
| Rotor number | 66 |
| Residues number | 0 |
| Canonical smiles | CC[C@@H]([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[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)CCCNC(=N)N)C)C)Cc1ccc(cc1)O)CCC(=O)O)C)CC(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)N)CCCNC(=N)N)CC(C)C)C |
