calcium potassium (1S,2R)-1,2-bis(oxidanyl)propane-1,2,3-tricarboxylate

Systemtic Name: calcium potassium (1S,2R)-1,2-bis(oxidanyl)propane-1,2,3-tricarboxylate Openeye Name: calcium potassium (1S,2R)-1,2-dihydroxypropane-1,2,3-tricarboxylate CAS Name: calcium potassium (1S,2R)-1,2-dihydroxypropane-1,2,3-tricarboxylate IUPAC Name: calcium potassium (1S,2R)-1,2-dihydroxypropane-1,2,3-tricarboxylate Traditional Name: calcium potassium (1S,2R)-1,2-dihydroxypropane-1,2,3-tricarboxylate Formula: C6H5CaKO8 MolecularWeight: 284.2754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C(C(=O)[O-])[C@@]([C@@H](C(=O)[O-])O)(C(=O)[O-])O.[K+].[Ca+2]

InChI

InChI=1S/C6H8O8.Ca.K/c7-2(8)1-6(14,5(12)13)3(9)4(10)11;;/h3,9,14H,1H2,(H,7,8)(H,10,11)(H,12,13);;/q;+2;+1/p-3/t3-,6-;;/m1../s1