Base information
| Cat. No. | |
| CAS No. | 554449-27-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H28O7 |
| Molecular Weight | 404.454 |
| Exact Mass | 404.184 |
| XLogP3 | 2.5543 |
| Mr | 106.761 |
| PSA | 99.13 |
| Sequence | - |
| Atom number | 57 |
| Bond number | 58 |
| Ring number | 2 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | OC/C=C(/C(=O)O[C@@H]1C/C(=C/CC/C(=C/[C@@H]2[C@@H]1C(=C)C(=O)O2)/C)/COC(=O)C)\C |
