Molecule ID: mol36621

SMILES: COC(=O)[C@H]1[C@](C)(C(=O)O)CCC[C@]1(C)C(=O)O

InChI: InChI=1S/C12H18O6/c1-11(9(14)15)5-4-6-12(2,10(16)17)7(11)8(13)18-3/h7H,4-6H2,1-3H3,(H,14,15)(H,16,17)/t7-,11+,12-

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.18 QSARToolbox 0 » -1
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Charge States and Microspecies Visualization