4-oxidanyl-3,4-bis(oxidanylidene)butanoate; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: 4-oxidanyl-3,4-bis(oxidanylidene)butanoate; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: 4-hydroxy-3,4-dioxo-butanoate citrate CAS Name: 4-hydroxy-3,4-dioxobutanoate; 2-hydroxypropane-1,2,3-tricarboxylate IUPAC Name: 4-hydroxy-3,4-dioxobutanoate; 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: 4-hydroxy-3,4-diketo-butyrate citrate Formula: C10H8O12-4 MolecularWeight: 320.16332

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)C(=O)O)C(=O)[O-].C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

C(C(=O)C(=O)O)C(=O)[O-].C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C6H8O7.C4H4O5/c7-3(8)1-6(13,5(11)12)2-4(9)10;5-2(4(8)9)1-3(6)7/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);1H2,(H,6,7)(H,8,9)/p-4