potassium 4-[(2S,3R,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,3,5,6-tetrakis(oxidanyl)hexanoate

Systemtic Name: potassium 4-[(2S,3R,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,3,5,6-tetrakis(oxidanyl)hexanoate Openeye Name: potassium 2,3,5,6-tetrahydroxy-4-[(2S,3R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-hexanoate CAS Name: potassium 2,3,5,6-tetrahydroxy-4-[[(2S,3R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]hexanoate IUPAC Name: potassium 2,3,5,6-tetrahydroxy-4-[(2S,3R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoate Traditional Name: potassium 2,3,5,6-tetrahydroxy-4-[(2S,3R,5R,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-hexanoate Formula: C12H21KO12 MolecularWeight: 396.38624

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Descriptors Computed from Structure

Canonical SMILES:

C(C1C(C(C(C(O1)OC(C(CO)O)C(C(C(=O)[O-])O)O)O)O)O)O.[K+]

Isomeric SMILES

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

InChI

InChI=1S/C12H22O12.K/c13-1-3(15)10(7(18)8(19)11(21)22)24-12-9(20)6(17)5(16)4(2-14)23-12;/h3-10,12-20H,1-2H2,(H,21,22);/q;+1/p-1/t3?,4-,5+,6?,7?,8?,9-,10?,12+;/m1./s1