Molecule ID: mol35069

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

InChI: InChI=1S/C13H24O7/c1-5(2)10(6(3)4)19-13-9(16)7(14)8(15)11(20-13)12(17)18/h5-11,13-16H,1-4H3,(H,17,18)/t7-,8-,9+,11-,13+/m0/s1

Experimental Macro pKa Values

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