Molecule ID: mol37489
SMILES: O=C1OC(c2cc3c(O)c(c2)COCCOCCOCCOCCOC3)(c2cc3c(O)c(c2)COCCOCCOCCOCCOC3)c2ccccc21
InChI: InChI=1S/C40H50O14/c41-37-29-21-33(22-30(37)26-51-18-14-47-10-6-44-5-9-46-13-17-50-25-29)40(36-4-2-1-3-35(36)39(43)54-40)34-23-31-27-52-19-15-48-11-7-45-8-12-49-16-20-53-28-32(24-34)38(31)42/h1-4,21-24,41-42H,5-20,25-28H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.40 | QSARToolbox | 0 » -1 |