dicalcium; 2-oxidanylpropane-1,2,3-tricarboxylate; 2-oxidanylpropanoate

Systemtic Name: dicalcium; 2-oxidanylpropane-1,2,3-tricarboxylate; 2-oxidanylpropanoate Openeye Name: dicalcium 2-hydroxypropanoate citrate CAS Name: dicalcium; 2-hydroxypropane-1,2,3-tricarboxylate; 2-hydroxypropanoate IUPAC Name: dicalcium; 2-hydroxypropane-1,2,3-tricarboxylate; 2-hydroxypropanoate Traditional Name: dicalcium lactate citrate Formula: C9H10Ca2O10 MolecularWeight: 358.3257

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H8O7.C3H6O3.2Ca/c7-3(8)1-6(13,5(11)12)2-4(9)10;1-2(4)3(5)6;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);2,4H,1H3,(H,5,6);;/q;;2*+2/p-4