Base information
| Cat. No. | |
| CAS No. | 223777-15-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H18N2O7 |
| Molecular Weight | 302.281 |
| Exact Mass | 302.111 |
| XLogP3 | -2.1812 |
| Mr | 69.6983 |
| PSA | 123.01 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 40 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | COCCO[C@@H]1[C@H](O)[C@H](O[C@H]1n1ccc(=O)[nH]c1=O)CO |
