Base information
| Cat. No. | |
| CAS No. | 120815-74-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C25H36O5S |
| Molecular Weight | 448.615 |
| Exact Mass | 448.228 |
| XLogP3 | 4.0701 |
| Mr | 123.653 |
| PSA | 119.47 |
| Sequence | - |
| Atom number | 67 |
| Bond number | 70 |
| Ring number | 4 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCCC(=O)O[C@@]1(CC[C@@H]2[C@]1(C)C[C@H](O)[C@H]1[C@H]2CCC2=CC(=O)CC[C@]12C)C(=O)CS |
