Molecule ID: mol8515

SMILES: N[C@@H](C[S+]([O-])CC(=O)O)C(=O)O

InChI: InChI=1S/C5H9NO5S/c6-3(5(9)10)1-12(11)2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-,12?/m0/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
7.90 IUPAC digitized pKa -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization