butanedioate; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: butanedioate; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: butanedioate citrate CAS Name: butanedioate; 2-hydroxypropane-1,2,3-tricarboxylate IUPAC Name: butanedioate; 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: succinate citrate Formula: C14H13O15-7 MolecularWeight: 421.24402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H8O7.2C4H6O4/c7-3(8)1-6(13,5(11)12)2-4(9)10;2*5-3(6)1-2-4(7)8/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);2*1-2H2,(H,5,6)(H,7,8)/p-7