copper potassium 2,3,4,5-tetrakis(oxidanyl)-6-oxidanylidene-hexanoate

Systemtic Name: copper potassium 2,3,4,5-tetrakis(oxidanyl)-6-oxidanylidene-hexanoate Openeye Name: copper potassium 2,3,4,5-tetrahydroxy-6-oxo-hexanoate CAS Name: copper potassium 2,3,4,5-tetrahydroxy-6-oxohexanoate IUPAC Name: copper potassium 2,3,4,5-tetrahydroxy-6-oxohexanoate Traditional Name: cupric potassium 2,3,4,5-tetrahydroxy-6-keto-hexanoate Formula: C60H90CuKO70-7 MolecularWeight: 2033.9589

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Descriptors Computed from Structure

Canonical SMILES:

C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.[K+].[Cu+2]

Isomeric SMILES

C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.[K+].[Cu+2]

InChI

InChI=1S/10C6H10O7.Cu.K/c10*7-1-2(8)3(9)4(10)5(11)6(12)13;;/h10*1-5,8-11H,(H,12,13);;/q;;;;;;;;;;+2;+1/p-10