Molecule ID: mol15741

SMILES: O=C(NO)[C@@H]1[C@H](C(=O)NO)[C@@H]2CC[C@H]1O2

InChI: InChI=1S/C8H12N2O5/c11-7(9-13)5-3-1-2-4(15-3)6(5)8(12)10-14/h3-6,13-14H,1-2H2,(H,9,11)(H,10,12)/t3-,4+,5+,6-

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
9.30 Datawarrior 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization