Base information
| Cat. No. | |
| CAS No. | 158861-67-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C45H55N9O6 |
| Molecular Weight | 817.975 |
| Exact Mass | 817.428 |
| XLogP3 | 5.8098 |
| Mr | 229.215 |
| PSA | 256.42 |
| Sequence | - |
| Atom number | 115 |
| Bond number | 119 |
| Ring number | 5 |
| Rotor number | 26 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)N)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc2c(c1)cccc2)NC(=O)[C@H](N)C)C |
