Base information
| Cat. No. | |
| CAS No. | 185698-23-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C42H52N8O14 |
| Molecular Weight | 892.907 |
| Exact Mass | 892.36 |
| XLogP3 | 4.8093 |
| Mr | 241.159 |
| PSA | 308.33 |
| Sequence | - |
| Atom number | 116 |
| Bond number | 120 |
| Ring number | 5 |
| Rotor number | 26 |
| Residues number | 0 |
| Canonical smiles | COc1ccc2c(c1)oc(=O)cc2CC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](C(=O)O)CCCCNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])CC(C)C |