Base information
| Cat. No. | |
| CAS No. | 480998-12-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C37H43ClN4O13 |
| Molecular Weight | 787.209 |
| Exact Mass | 786.252 |
| XLogP3 | 2.2209 |
| Mr | 198.807 |
| PSA | 267.84 |
| Sequence | - |
| Atom number | 98 |
| Bond number | 102 |
| Ring number | 6 |
| Rotor number | 13 |
| Residues number | 0 |
| Canonical smiles | OC/C(=N\NC(=O)CCCCCN1C(=O)C=CC1=O)/[C@@]1(O)C[C@H](O[C@H]2C[C@H](N)[C@@H]([C@@H](O2)C)O)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2OC.Cl |
