Base information
| Cat. No. | |
| CAS No. | 115713-06-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H30O14 |
| Molecular Weight | 518.465 |
| Exact Mass | 518.164 |
| XLogP3 | -3.8473 |
| Mr | 112.833 |
| PSA | 214.06 |
| Sequence | - |
| Atom number | 66 |
| Bond number | 69 |
| Ring number | 4 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](O[C@@H]3OC=C4C(=CCOC4=O)[C@H]3C=C)[C@@H]([C@H]([C@@H]2O)O)O)[C@@H]([C@H]([C@@H]1O)O)O |
