Molecule ID: mol843
SMILES: CCCC[C@@H](CC)COP(=O)(O)OC[C@H](CC)CCCC
InChI: InChI=1S/C16H35O4P/c1-5-9-11-15(7-3)13-19-21(17,18)20-14-16(8-4)12-10-6-2/h15-16H,5-14H2,1-4H3,(H,17,18)/t15-,16-/m1/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.85 | OCHEM | 0 » -1 |
| 2.85 | Hunt | 0 » -1 |