Base information
| Cat. No. | |
| CAS No. | 2172997-02-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C38H20O16S4 |
| Molecular Weight | 860.816 |
| Exact Mass | 859.963 |
| XLogP3 | 7.7106 |
| Mr | 212.46 |
| PSA | 399.6 |
| Sequence | - |
| Atom number | 78 |
| Bond number | 83 |
| Ring number | 6 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1cc(cc(c1)C(=O)O)C1=C(S/C(=C\2/SC(=C(S2)c2cc(cc(c2)C(=O)O)C(=O)O)c2cc(cc(c2)C(=O)O)C(=O)O)/S1)c1cc(cc(c1)C(=O)O)C(=O)O |
