Molecule ID: mol18530

SMILES: Oc1cccc2cccc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c12

InChI: InChI=1S/C15H16O6/c16-9-5-1-3-8-4-2-6-11(12(8)9)21-15-14(19)13(18)10(17)7-20-15/h1-6,10,13-19H,7H2/t10-,13+,14-,15+/m1/s1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization