2,3-bis(oxidanyl)propyl phosphate; iron(3+)

Systemtic Name: 2,3-bis(oxidanyl)propyl phosphate; iron(3+) Openeye Name: diferric 2,3-dihydroxypropyl phosphate CAS Name: 2,3-dihydroxypropyl phosphate; iron(3+) IUPAC Name: 2,3-dihydroxypropyl phosphate; iron(3+) Traditional Name: diferric glyceryl phosphate Formula: C9H21Fe2O18P3 MolecularWeight: 621.863523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C3H9O6P.2Fe/c3*4-1-3(5)2-9-10(6,7)8;;/h3*3-5H,1-2H2,(H2,6,7,8);;/q;;;2*+3/p-6