potassium 3-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]sulfanylpropane-1-sulfonate

Systemtic Name: potassium 3-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]sulfanylpropane-1-sulfonate Openeye Name: potassium 3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]sulfanylpropane-1-sulfonate CAS Name: potassium 3-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]thio]-1-propanesulfonate IUPAC Name: potassium 3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylpropane-1-sulfonate Traditional Name: potassium 3-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]thio]propane-1-sulfonate Formula: C9H17KO8S2 MolecularWeight: 356.45478

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Descriptors Computed from Structure

Canonical SMILES:

C(CSC1C(C(C(C(O1)CO)O)O)O)CS(=O)(=O)[O-].[K+]

Isomeric SMILES

C(CS[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)CS(=O)(=O)[O-].[K+]

InChI

InChI=1S/C9H18O8S2.K/c10-4-5-6(11)7(12)8(13)9(17-5)18-2-1-3-19(14,15)16;/h5-13H,1-4H2,(H,14,15,16);/q;+1/p-1/t5-,6-,7+,8-,9+;/m1./s1