calcium 2,3,4-tris(oxidanyl)-4-oxidanylidene-butanoate

Systemtic Name: calcium 2,3,4-tris(oxidanyl)-4-oxidanylidene-butanoate Openeye Name: calcium 2,3,4-trihydroxy-4-oxo-butanoate CAS Name: calcium 2,3,4-trihydroxy-4-oxobutanoate IUPAC Name: calcium 2,3,4-trihydroxy-4-oxobutanoate Traditional Name: calcium 2,3,4-trihydroxy-4-keto-butyrate Formula: C8H10CaO12 MolecularWeight: 338.2358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C4H6O6.Ca/c2*5-1(3(7)8)2(6)4(9)10;/h2*1-2,5-6H,(H,7,8)(H,9,10);/q;;+2/p-2