pentasodium; hydrogen phosphate; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: pentasodium; hydrogen phosphate; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: pentasodium hydrogen phosphate citrate CAS Name: pentasodium; hydrogen phosphate; 2-hydroxypropane-1,2,3-tricarboxylate IUPAC Name: pentasodium; hydrogen phosphate; 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: pentasodium hydrogen phosphate citrate Formula: C6H6Na5O11P MolecularWeight: 400.027851

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C6H8O7.5Na.H3O4P/c7-3(8)1-6(13,5(11)12)2-4(9)10;;;;;;1-5(2,3)4/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;;;;(H3,1,2,3,4)/q;5*+1;/p-5