Base information
| Cat. No. | |
| CAS No. | 714192-43-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C33H46NO9+ |
| Molecular Weight | 600.72 |
| Exact Mass | 600.317 |
| XLogP3 | 5.1094 |
| Mr | 168.956 |
| PSA | 109.75 |
| Sequence | - |
| Atom number | 89 |
| Bond number | 91 |
| Ring number | 3 |
| Rotor number | 18 |
| Residues number | 0 |
| Canonical smiles | COc1cc2c(cc1OC)CC[N@@+]([C@@H]2Cc1cc(OC)c(c(c1)OC)OC)(C)CCCOC(=O)CC/C=C/CCC(=O)O |
