calcium; 2,3-bis(oxidanyl)butanedioate; ethanoic acid; heptahydrate

Systemtic Name: calcium; 2,3-bis(oxidanyl)butanedioate; ethanoic acid; heptahydrate Openeye Name: calcium; acetic acid; 2,3-dihydroxybutanedioate; heptahydrate CAS Name: calcium; acetic acid; 2,3-dihydroxybutanedioate; heptahydrate IUPAC Name: calcium; acetic acid; 2,3-dihydroxybutanedioate; heptahydrate Traditional Name: calcium acetic acid tartrate heptahydrate Formula: C6H22CaO15 MolecularWeight: 374.30788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C4H6O6.C2H4O2.Ca.7H2O/c5-1(3(7)8)2(6)4(9)10;1-2(3)4;;;;;;;;/h1-2,5-6H,(H,7,8)(H,9,10);1H3,(H,3,4);;7*1H2/q;;+2;;;;;;;/p-2