calcium 2-[2,4-bis(oxidanyl)-4-oxidanylidene-butanoyl]oxy-3-oxidanyl-butanedioate

Systemtic Name: calcium 2-[2,4-bis(oxidanyl)-4-oxidanylidene-butanoyl]oxy-3-oxidanyl-butanedioate Openeye Name: calcium 2-(2,4-dihydroxy-4-oxo-butanoyl)oxy-3-hydroxy-butanedioate CAS Name: calcium 2-(2,4-dihydroxy-1,4-dioxobutoxy)-3-hydroxybutanedioate IUPAC Name: calcium 2-(2,4-dihydroxy-4-oxobutanoyl)oxy-3-hydroxybutanedioate Traditional Name: calcium 2-(2,4-dihydroxy-4-keto-butanoyl)oxy-3-hydroxy-succinate Formula: C8H8CaO10 MolecularWeight: 304.22112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H10O10.Ca/c9-2(1-3(10)11)8(17)18-5(7(15)16)4(12)6(13)14;/h2,4-5,9,12H,1H2,(H,10,11)(H,13,14)(H,15,16);/q;+2/p-2