pentapotassium 2-phosphonatooxypropane-1,2,3-tricarboxylate

Systemtic Name: pentapotassium 2-phosphonatooxypropane-1,2,3-tricarboxylate Openeye Name: pentapotassium 2-phosphonatooxypropane-1,2,3-tricarboxylate CAS Name: pentapotassium 2-phosphonatooxypropane-1,2,3-tricarboxylate IUPAC Name: pentapotassium 2-phosphonatooxypropane-1,2,3-tricarboxylate Traditional Name: pentapotassium 2-phosphatopropane-1,2,3-tricarboxylate Formula: C6H4K5O10P MolecularWeight: 462.555221

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H9O10P.5K/c7-3(8)1-6(5(11)12,2-4(9)10)16-17(13,14)15;;;;;/h1-2H2,(H,7,8)(H,9,10)(H,11,12)(H2,13,14,15);;;;;/q;5*+1/p-5