Base information
| Cat. No. | |
| CAS No. | 21586-90-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H28O9 |
| Molecular Weight | 412.431 |
| Exact Mass | 412.173 |
| XLogP3 | -2.1614 |
| Mr | 96.1068 |
| PSA | 156.91 |
| Sequence | - |
| Atom number | 57 |
| Bond number | 61 |
| Ring number | 5 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O[C@H]1C=C(C)[C@H]2[C@@]([C@@H]1O)(C)C1[C@@H](O)[C@H](O)[C@@]3([C@]4([C@@]1([C@@H](C2)OC(=O)[C@@H]4O)CO3)O)C |
