Base information
| Cat. No. | |
| CAS No. | 77368-59-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C24H31N7O13 |
| Molecular Weight | 625.542 |
| Exact Mass | 625.198 |
| XLogP3 | -3.2505 |
| Mr | 141.501 |
| PSA | 329.61 |
| Sequence | - |
| Atom number | 75 |
| Bond number | 77 |
| Ring number | 3 |
| Rotor number | 15 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CC[C@@H](C(=O)O)NC(=O)[C@H]([C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1ccc(=O)[nH]c1=O)NC(=O)[C@H](C(C(c1ncc(cn1)O)O)C)N |
