Molecule ID: mol13359

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

InChI: InChI=1S/C11H18O3/c1-2-9(10(12)13)11(14)6-7-3-4-8(11)5-7/h7-9,14H,2-6H2,1H3,(H,12,13)/t7-,8+,9+,11+/m0/s1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization