calcium; 2-oxidanylbutanedioate; propane-1,2,3-triol

Systemtic Name: calcium; 2-oxidanylbutanedioate; propane-1,2,3-triol Openeye Name: calcium; glycerol; 2-hydroxybutanedioate CAS Name: calcium; 2-hydroxybutanedioate; propane-1,2,3-triol IUPAC Name: calcium; 2-hydroxybutanedioate; propane-1,2,3-triol Traditional Name: calcium; glycerol; 2-hydroxysuccinate Formula: C7H12CaO8 MolecularWeight: 264.24338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C4H6O5.C3H8O3.Ca/c5-2(4(8)9)1-3(6)7;4-1-3(6)2-5;/h2,5H,1H2,(H,6,7)(H,8,9);3-6H,1-2H2;/q;;+2/p-2