Base information
| Cat. No. | |
| CAS No. | 102040-03-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C63H98O29 |
| Molecular Weight | 1319.43 |
| Exact Mass | 1318.62 |
| XLogP3 | -2.6764 |
| Mr | 309.59 |
| PSA | 445.19 |
| Sequence | - |
| Atom number | 190 |
| Bond number | 200 |
| Ring number | 11 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H]2O[C@H]3[C@@H](O)C[C@]4([C@H]([C@]3(C)COC(=O)CC(CC(=O)O[C@H]3[C@H](O[C@@H]2[C@H]([C@@H]1O)O)OC[C@@H]([C@@H]3O)O)(C)O)CC[C@@]1([C@@H]4CC=C2[C@@]1(C)CC[C@@]1([C@H]2CC(C)(C)CC1)C(=O)O[C@@H]1OC[C@@H]([C@@H]([C@H]1O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)O)O)O)C)C |
