Base information
| Cat. No. | |
| CAS No. | 72099-45-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C23H29NO6 |
| Molecular Weight | 415.479 |
| Exact Mass | 415.199 |
| XLogP3 | 0.3988 |
| Mr | 112.656 |
| PSA | 116.42 |
| Sequence | - |
| Atom number | 59 |
| Bond number | 63 |
| Ring number | 5 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OCC(=O)C12N=C(OC1C[C@H]1[C@]2(C)C[C@H](O)[C@@H]2[C@H]1C[C@H](C1=CC(=O)C=C[C@]21C)O)C |
