Base information
| Cat. No. | |
| CAS No. | 84331-34-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C51H53ClO28 |
| Molecular Weight | 1149.4 |
| Exact Mass | 1148.24 |
| XLogP3 | -4.6112 |
| Mr | 267.205 |
| PSA | 465.03 |
| Sequence | - |
| Atom number | 133 |
| Bond number | 139 |
| Ring number | 8 |
| Rotor number | 18 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@@H](Oc2cc3c(cc(cc3[o+]c2c2cc(O)c(c(c2)O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(c(c3)O)O)[C@H]([C@@H]([C@H]2O)O)O)O)O)O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(c(c3)O)O)[C@H]([C@@H]([C@H]2O)O)O)[C@@H]([C@H]([C@@H]1O)O)O.[Cl-] |