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calcium 2,2,3-tris(oxidanyl)pentanedioate

calcium 2,2,3-tris(oxidanyl)pentanedioate

Systemtic Name:calcium 2,2,3-tris(oxidanyl)pentanedioate
Openeye Name:calcium 2,2,3-trihydroxypentanedioate
CAS Name:calcium 2,2,3-trihydroxypentanedioate
IUPAC Name:calcium 2,2,3-trihydroxypentanedioate
Traditional Name:calcium 2,2,3-trihydroxyglutarate
Formula: C5H6CaO7
MolecularWeight: 218.17494
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C5H8O7.Ca/c6-2(1-3(7)8)5(11,12)4(9)10;/h2,6,11-12H,1H2,(H,7,8)(H,9,10);/q;+2/p-2


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