Base information
| Cat. No. | |
| CAS No. | 28513-29-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H31NO7 |
| Molecular Weight | 397.463 |
| Exact Mass | 397.21 |
| XLogP3 | 1.1612 |
| Mr | 108.188 |
| PSA | 122.49 |
| Sequence | - |
| Atom number | 59 |
| Bond number | 60 |
| Ring number | 2 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | C/C=C(/C(=O)O[C@@H]([C@](C(=O)OCC1=CC[N+]2([C@H]1[C@H](O)CC2)[O-])(C(C)C)O)C)\C |
