calcium; 2-oxidanylbutanedioate; 2-oxidanylpropanoate

Systemtic Name: calcium; 2-oxidanylbutanedioate; 2-oxidanylpropanoate Openeye Name: calcium; 2-hydroxybutanedioate; 2-hydroxypropanoate CAS Name: calcium; 2-hydroxybutanedioate; 2-hydroxypropanoate IUPAC Name: calcium; 2-hydroxybutanedioate; 2-hydroxypropanoate Traditional Name: calcium; 2-hydroxysuccinate; lactate Formula: C7H9CaO8- MolecularWeight: 261.21956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C4H6O5.C3H6O3.Ca/c5-2(4(8)9)1-3(6)7;1-2(4)3(5)6;/h2,5H,1H2,(H,6,7)(H,8,9);2,4H,1H3,(H,5,6);/q;;+2/p-3