Base information
| Cat. No. | |
| CAS No. | 174063-90-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C63H103N25O19 |
| Molecular Weight | 1514.65 |
| Exact Mass | 1513.79 |
| XLogP3 | 0.0053 |
| Mr | 377.519 |
| PSA | 769.24 |
| Sequence | - |
| Atom number | 210 |
| Bond number | 211 |
| Ring number | 2 |
| Rotor number | 62 |
| Residues number | 0 |
| Canonical smiles | CC[C@@H]([C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)N)CCC(=O)N)CC(=O)O)CCCN=C(N)N)Cc1ccccc1)Cc1[nH]cnc1)CO)CCCN=C(N)N)CC(=O)N)CO)C |
