BDBM50229337 CHEMBL3706384

SMILES [K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[H][C@@]12OC(COS([O-])(=O)=O)[C@@]([H])(O[C@@]3([H])OC(COS([O-])(=O)=O)[C@@]([H])(O[C@]4([H])OC(COS([O-])(=O)=O)[C@@]([H])(O[C@@]5([H])OC(COS([O-])(=O)=O)[C@@]([H])(O[C@@]6([H])OC(COS([O-])(=O)=O)[C@@]([H])(O[C@@]7([H])OC(COS([O-])(=O)=O)[C@@]([H])(O[C@@]8([H])OC(COS(=O)(=O)c9c(C)cc(C)cc9C)[C@@]([H])(O1)C(O)C8OS([O-])(=O)=O)C(O)C7OS([O-])(=O)=O)C(OS([O-])(=O)=O)C6OS([O-])(=O)=O)C(O)C5OS([O-])(=O)=O)C(OS([O-])(=O)=O)C4OS([O-])(=O)=O)C(OS([O-])(=O)=O)C3OS([O-])(=O)=O)C(O)C2OS([O-])(=O)=O

InChI Key InChIKey=RJZTVQPVXSGONV-KSYXKOCXSA-A

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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