Base information
| Cat. No. | |
| CAS No. | 756525-99-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H31N3O11 |
| Molecular Weight | 513.495 |
| Exact Mass | 513.196 |
| XLogP3 | -1.2519 |
| Mr | 126.215 |
| PSA | 167.08 |
| Sequence | - |
| Atom number | 67 |
| Bond number | 68 |
| Ring number | 2 |
| Rotor number | 21 |
| Residues number | 0 |
| Canonical smiles | O=C(CCN1C(=O)C=CC1=O)NCCOCCOCCOCCOCCC(=O)ON1C(=O)CCC1=O |
