Base information
| Cat. No. | |
| CAS No. | 142561-99-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C42H47O23+ |
| Molecular Weight | 919.809 |
| Exact Mass | 919.251 |
| XLogP3 | -1.352 |
| Mr | 214.956 |
| PSA | 367.04 |
| Sequence | - |
| Atom number | 112 |
| Bond number | 118 |
| Ring number | 7 |
| Rotor number | 14 |
| Residues number | 0 |
| Canonical smiles | COc1cc(/C=C/C(=O)OC[C@H]2O[C@@H](OC[C@H]3O[C@@H](Oc4cc5c(O)cc(cc5[o+]c4c4ccc(c(c4)O)O)O)[C@@H]([C@H]([C@H]3O)O)O[C@@H]3OC[C@H]([C@@H]([C@H]3O)O)O)[C@@H]([C@H]([C@@H]2O)O)O)ccc1O |
