Base information
| Cat. No. | |
| CAS No. | 159143-77-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C25H40O7 |
| Molecular Weight | 452.581 |
| Exact Mass | 452.277 |
| XLogP3 | 2.7512 |
| Mr | 121.268 |
| PSA | 113.29 |
| Sequence | - |
| Atom number | 72 |
| Bond number | 74 |
| Ring number | 3 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CCC(C(=O)O[C@@H]1C[C@H](C)C(C2=CC([C@@H]([C@@H]([C@@H]12)CCC1C[C@@H](O)CC(=O)O1)C)O)O)(C)C |
