Base information
| Cat. No. | |
| CAS No. | 60683-15-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C29H30N2O14S |
| Molecular Weight | 662.618 |
| Exact Mass | 662.142 |
| XLogP3 | 1.7706 |
| Mr | 155.618 |
| PSA | 301.9 |
| Sequence | - |
| Atom number | 76 |
| Bond number | 79 |
| Ring number | 5 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CN([C@@H]1C(=C(C(=O)N)C(=O)[C@@]2([C@H]1[C@@H](O)[C@@H]1[C@@H](C)c3cccc(c3C(=O)C1=C2O)O)O)O)C.OC(=O)c1cc(ccc1O)S(=O)(=O)O |
