Base information
| Cat. No. | |
| CAS No. | 6850-30-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C28H36O6 |
| Molecular Weight | 468.582 |
| Exact Mass | 468.251 |
| XLogP3 | 3.5611 |
| Mr | 126.528 |
| PSA | 93.2 |
| Sequence | - |
| Atom number | 70 |
| Bond number | 75 |
| Ring number | 6 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OCC1=C(C)C[C@@H](OC1=O)[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2C[C@@H]2[C@]3([C@]1(C)C(=O)C=CC3=O)O2)C |
