Base information
| Cat. No. | |
| CAS No. | 79558-09-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H26O7 |
| Molecular Weight | 402.438 |
| Exact Mass | 402.168 |
| XLogP3 | 3.8586 |
| Mr | 108.429 |
| PSA | 102.29 |
| Sequence | - |
| Atom number | 55 |
| Bond number | 56 |
| Ring number | 2 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | CCCc1c(OCCCOc2ccc(cc2)OCC(=O)O)ccc(c1O)C(=O)C |