Base information
| Cat. No. | |
| CAS No. | 546-97-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H22O6 |
| Molecular Weight | 358.385 |
| Exact Mass | 358.142 |
| XLogP3 | 2.5327 |
| Mr | 90.0988 |
| PSA | 85.97 |
| Sequence | - |
| Atom number | 48 |
| Bond number | 52 |
| Ring number | 5 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=C1O[C@@H](C[C@@]2([C@H]1CC[C@@]1([C@H]2[C@H]2C=C[C@]1(O)C(=O)O2)C)C)c1cocc1 |
