Base information
| Cat. No. | |
| CAS No. | 87745-28-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C45H66O16 |
| Molecular Weight | 862.996 |
| Exact Mass | 862.435 |
| XLogP3 | 3.7091 |
| Mr | 221.363 |
| PSA | 234.04 |
| Sequence | - |
| Atom number | 127 |
| Bond number | 130 |
| Ring number | 4 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | CCC/C=C/C=C/C(=O)O[C@H]1/C(=C/C(=O)OC)/C[C@@H]2O[C@@]1(O)C(C)(C)/C=C/[C@@H]1O[C@@H](C/C(=C/C(=O)OC)/C1)C[C@]1(O)O[C@H](C[C@H](CC(=O)O[C@H](C2)[C@H](O)C)O)C[C@@H](C1(C)C)O |
