Base information
| Cat. No. | |
| CAS No. | 85079-48-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C50H72O14 |
| Molecular Weight | 897.098 |
| Exact Mass | 896.492 |
| XLogP3 | 5.2655 |
| Mr | 232.437 |
| PSA | 159.06 |
| Sequence | - |
| Atom number | 136 |
| Bond number | 146 |
| Ring number | 11 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OCC(=C)C[C@@H]1C[C@H](O)[C@]2([C@H](O1)C[C@H]1[C@H](O2)C[C@H]2[C@H](O1)C=CC[C@]1([C@H](O2)C[C@]2(C)O[C@]3(C)CC[C@H]4[C@H](O[C@H]3C[C@H]2O1)[C@H](C)C[C@H]1[C@H](O4)C[C@]2(C)O[C@@H]3C(=CC(=O)O[C@H]3C[C@H]2O1)C)C)C |
