octapotassium [(2R,3R,4S,5R,6R)-3,5-disulfonatooxy-2-(sulfonatooxymethyl)-6-[(2R,3R,4S,5R,6R)-3,4,5-trisulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-oxan-4-yl] sulfate

Systemtic Name: octapotassium [(2R,3R,4S,5R,6R)-3,5-disulfonatooxy-2-(sulfonatooxymethyl)-6-[(2R,3R,4S,5R,6R)-3,4,5-trisulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-oxan-4-yl] sulfate Openeye Name: octapotassium [(2R,3R,4S,5R,6R)-3,5-disulfonatooxy-2-(sulfonatooxymethyl)-6-[(2R,3R,4S,5R,6R)-3,4,5-trisulfonatooxy-6-(sulfonatooxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-4-yl] sulfate CAS Name: octapotassium [(2R,3R,4S,5R,6R)-3,5-disulfonatooxy-2-(sulfonatooxymethyl)-6-[[(2R,3R,4S,5R,6R)-3,4,5-trisulfonatooxy-6-(sulfonatooxymethyl)-2-oxanyl]oxy]-4-oxanyl] sulfate IUPAC Name: octapotassium [(2R,3R,4S,5R,6R)-3,5-disulfonatooxy-2-(sulfonatooxymethyl)-6-[(2R,3R,4S,5R,6R)-3,4,5-trisulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxyoxan-4-yl] sulfate Traditional Name: octapotassium [(2R,3R,4S,5R,6R)-3,5-disulfato-2-(sulfatomethyl)-6-[(2R,3R,4S,5R,6R)-3,4,5-trisulfato-6-(sulfatomethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-4-yl] sulfate Formula: C12H14K8O35S8 MolecularWeight: 1287.52496

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Descriptors Computed from Structure

Canonical SMILES:

C(C1C(C(C(C(O1)OC2C(C(C(C(O2)COS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+]

Isomeric SMILES

C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+]

InChI

InChI=1S/C12H22O35S8.8K/c13-48(14,15)37-1-3-5(42-50(19,20)21)7(44-52(25,26)27)9(46-54(31,32)33)11(39-3)41-12-10(47-55(34,35)36)8(45-53(28,29)30)6(43-51(22,23)24)4(40-12)2-38-49(16,17)18;;;;;;;;/h3-12H,1-2H2,(H,13,14,15)(H,16,17,18)(H,19,20,21)(H,22,23,24)(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36);;;;;;;;/q;8*+1/p-8/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12-;;;;;;;;/m1......../s1