Base information
| Cat. No. | |
| CAS No. | 175032-97-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C30H30N10O12S4 |
| Molecular Weight | 850.879 |
| Exact Mass | 850.093 |
| XLogP3 | 0.347 |
| Mr | 206.875 |
| PSA | 413.81 |
| Sequence | - |
| Atom number | 86 |
| Bond number | 91 |
| Ring number | 6 |
| Rotor number | 18 |
| Residues number | 0 |
| Canonical smiles | CO/N=C(/c1csc(n1)NCC1=C(C(=O)O)N2[C@H](SC1)[C@@H](C2=O)NC(=O)/C(=N\OC)/c1csc(n1)N)\C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)COC(=O)C |
