Base information
| Cat. No. | |
| CAS No. | 171066-85-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C45H82N10O10S |
| Molecular Weight | 955.259 |
| Exact Mass | 954.594 |
| XLogP3 | 4.5755 |
| Mr | 259.116 |
| PSA | 338.65 |
| Sequence | - |
| Atom number | 148 |
| Bond number | 148 |
| Ring number | 1 |
| Rotor number | 39 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)CC(C)C)CC(C)C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)N)CCSC |
