pentapotassium 2-(3-carboxylato-5-oxidanidyl-3-oxidanyl-5-oxidanylidene-pentanoyl)oxypropane-1,2,3-tricarboxylate

Systemtic Name: pentapotassium 2-(3-carboxylato-5-oxidanidyl-3-oxidanyl-5-oxidanylidene-pentanoyl)oxypropane-1,2,3-tricarboxylate Openeye Name: pentapotassium 2-(3-carboxylato-3-hydroxy-5-oxido-5-oxo-pentanoyl)oxypropane-1,2,3-tricarboxylate CAS Name: pentapotassium 2-(3-carboxylato-3-hydroxy-5-oxido-1,5-dioxopentoxy)propane-1,2,3-tricarboxylate IUPAC Name: pentapotassium 2-(3-carboxylato-3-hydroxy-5-oxido-5-oxopentanoyl)oxypropane-1,2,3-tricarboxylate Traditional Name: pentapotassium 2-(3-carboxylato-3-hydroxy-5-keto-5-oxido-pentanoyl)oxypropane-1,2,3-tricarboxylate Formula: C12H9K5O13 MolecularWeight: 556.68356

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)[O-])C(CC(=O)OC(CC(=O)[O-])(CC(=O)[O-])C(=O)[O-])(C(=O)[O-])O.[K+].[K+].[K+].[K+].[K+]

Isomeric SMILES

C(C(=O)[O-])C(CC(=O)OC(CC(=O)[O-])(CC(=O)[O-])C(=O)[O-])(C(=O)[O-])O.[K+].[K+].[K+].[K+].[K+]

InChI

InChI=1S/C12H14O13.5K/c13-5(14)1-11(24,9(20)21)4-8(19)25-12(10(22)23,2-6(15)16)3-7(17)18;;;;;/h24H,1-4H2,(H,13,14)(H,15,16)(H,17,18)(H,20,21)(H,22,23);;;;;/q;5*+1/p-5