Molecule ID: mol14700

SMILES: CN1[C@@H]2CC[C@H]1C[C@H](OC(=O)C(O)c1ccccc1)C2

InChI: InChI=1S/C16H21NO3/c1-17-12-7-8-13(17)10-14(9-12)20-16(19)15(18)11-5-3-2-4-6-11/h2-6,12-15,18H,7-10H2,1H3/t12-,13+,14-,15?

Experimental Macro pKa Values

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