Base information
| Cat. No. | |
| CAS No. | 438625-61-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C84H123N27O27 |
| Molecular Weight | 1943.04 |
| Exact Mass | 1941.91 |
| XLogP3 | 5.9667 |
| Mr | 496.552 |
| PSA | 899.12 |
| Sequence | - |
| Atom number | 261 |
| Bond number | 264 |
| Ring number | 4 |
| Rotor number | 78 |
| Residues number | 0 |
| Canonical smiles | OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCCNC(=N)N)CCCNC(=N)N)CCCCNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])CCCNC(=N)N)Cc1ccccc1)CCC(=O)O)C)CC(=O)O)CC(C)C)CC(=O)N)C(C)C)CCC(=O)O)Nc1ccc2c(c1)oc(=O)cc2C |