BDBM50229338 CHEMBL3706383

SMILES [Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[H][C@@]12OC(CNc3ccc(OC)cc3)[C@@]([H])(O[C@@]3([H])OC(CNc4ccc(OC)cc4)[C@@]([H])(O[C@@]4([H])OC(CNc5ccc(OC)cc5)[C@@]([H])(O[C@]5([H])OC(CNc6ccc(OC)cc6)[C@@]([H])(O[C@@]6([H])OC(CNc7ccc(OC)cc7)[C@@]([H])(O[C@@]7([H])OC(CNc8ccc(OC)cc8)[C@@]([H])(O[C@@]8([H])OC(CNc9ccc(OC)cc9)[C@@]([H])(O1)C(OS([O-])(=O)=O)C8OS([O-])(=O)=O)C(OS([O-])(=O)=O)C7OS([O-])(=O)=O)C(O)C6OS([O-])(=O)=O)C(OS([O-])(=O)=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=ADQWQKSZYUBZJD-PEVZJRDUSA-B

Data  1 IC50

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