Molecule ID: mol15583

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

InChI: InChI=1S/C13H19NO5/c1-7(2)10-6-14(8(3)15)12(13(18)19-4)9(10)5-11(16)17/h9-10,12H,1,5-6H2,2-4H3,(H,16,17)/t9-,10+,12+/m1/s1

Experimental Macro pKa Values

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