Molecule ID: mol36643

SMILES: COC1=C(C2=C(O)C(=O)C(C)=CC2=O)C(=O)C=C(C)C1=O

InChI: InChI=1S/C15H12O6/c1-6-4-8(16)10(14(20)12(6)18)11-9(17)5-7(2)13(19)15(11)21-3/h4-5,20H,1-3H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
4.02 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization