Molecule ID: mol34974

SMILES: CC1c2cc(c(O)cc2O)C(C)c2cc(c(O)cc2O)C(C)c2cc(c(O)cc2O)C(C)c2cc1c(O)cc2O

InChI: InChI=1S/C32H32O8/c1-13-17-5-19(27(35)9-25(17)33)14(2)21-7-23(31(39)11-29(21)37)16(4)24-8-22(30(38)12-32(24)40)15(3)20-6-18(13)26(34)10-28(20)36/h5-16,33-40H,1-4H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
9.00 QSARToolbox 0 » -1
10.00 QSARToolbox -2 » -3
10.00 QSARToolbox -2 » -3
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization