iron(3+); 2-oxidanylpropane-1,2,3-tricarboxylate; hydrate

Systemtic Name: iron(3+); 2-oxidanylpropane-1,2,3-tricarboxylate; hydrate Openeye Name: ferric citrate hydrate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate; iron(3+); hydrate IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate; iron(3+); hydrate Traditional Name: ferric citrate hydrate Formula: C6H7FeO8 MolecularWeight: 262.95998

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.[Fe+3]

Isomeric SMILES

C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.[Fe+3]

InChI

InChI=1S/C6H8O7.Fe.H2O/c7-3(8)1-6(13,5(11)12)2-4(9)10;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;1H2/q;+3;/p-3