Base information
| Cat. No. | |
| CAS No. | 685132-59-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H27NO7 |
| Molecular Weight | 357.399 |
| Exact Mass | 357.179 |
| XLogP3 | 0.2149 |
| Mr | 94.2406 |
| PSA | 122.49 |
| Sequence | - |
| Atom number | 52 |
| Bond number | 53 |
| Ring number | 2 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | CC(=O)O[C@@H]1CC[N+]2([C@@H]1C(=CC2)COC(=O)[C@@]([C@H](O)C)(C(C)C)O)[O-] |
