Molecule ID: mol76
SMILES: CCC1OC(=O)CC(O)CC(OC2OC(C)CC(N(C)C)C2O)C(CC=O)CC(C)C(=O)C=CC2OC2C1C
InChI: InChI=1S/C29H47NO9/c1-7-23-18(4)28-24(38-28)9-8-22(33)16(2)12-19(10-11-31)25(14-20(32)15-26(34)37-23)39-29-27(35)21(30(5)6)13-17(3)36-29/h8-9,11,16-21,23-25,27-29,32,35H,7,10,12-15H2,1-6H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.79 | Settimo | 1 » 0 |