Base information
| Cat. No. | |
| CAS No. | 79517-01-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C51H70N10O12S2 |
| Molecular Weight | 1079.29 |
| Exact Mass | 1078.46 |
| XLogP3 | 3.1119 |
| Mr | 302.89 |
| PSA | 420.12 |
| Sequence | - |
| Atom number | 145 |
| Bond number | 148 |
| Ring number | 5 |
| Rotor number | 19 |
| Residues number | 0 |
| Canonical smiles | CC(=O)O.NCCCC[C@@H]1NC(=O)[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@H](NC1=O)[C@H](O)C)C(=O)N[C@@H]([C@H](O)C)CO)NC(=O)[C@@H](Cc1ccccc1)N)Cc1c[nH]c2c1cccc2 |
