Base information
| Cat. No. | |
| CAS No. | 88566-80-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C41H49N5O14 |
| Molecular Weight | 835.853 |
| Exact Mass | 835.328 |
| XLogP3 | 2.6949 |
| Mr | 218.481 |
| PSA | 270.02 |
| Sequence | - |
| Atom number | 109 |
| Bond number | 110 |
| Ring number | 5 |
| Rotor number | 14 |
| Residues number | 0 |
| Canonical smiles | OC(=O)C(CC(=O)O)(CC(=O)O)O.Cn1cnc2c1c(=O)n(C)c(=O)n2C.CC(=O)Oc1ccccc1C(=O)O.CN(CCOC(c1ccccc1C)c1ccccc1)C |
