Molecule ID: mol32473

SMILES: CC(O)C1CNC(C(=O)O)C1CC(=O)O

InChI: InChI=1S/C9H15NO5/c1-4(11)6-3-10-8(9(14)15)5(6)2-7(12)13/h4-6,8,10-11H,2-3H2,1H3,(H,12,13)(H,14,15)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
3.65 OCHEM 0 » -1
10.08 OCHEM -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization