Base information
| Cat. No. | |
| CAS No. | 34217-90-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C33H46N4O6 |
| Molecular Weight | 594.742 |
| Exact Mass | 594.342 |
| XLogP3 | 4.6643 |
| Mr | 178.722 |
| PSA | 160.95 |
| Sequence | - |
| Atom number | 89 |
| Bond number | 92 |
| Ring number | 4 |
| Rotor number | 13 |
| Residues number | 0 |
| Canonical smiles | CC[C@H]1C(=O)N[C@H]([C@@H]1C)CC1=N/C(=C\c2[nH]c(c(c2CCC(=O)O)C)C[C@@H]2NC(=O)[C@@H]([C@H]2CC)C)/C(=C1C)CCC(=O)O |
