2-[(1S)-1,2-bis(oxidanyl)ethyl]-4,5-bis(oxidanyl)furan-3-one; iron(2+); sulfate

Systemtic Name: 2-[(1S)-1,2-bis(oxidanyl)ethyl]-4,5-bis(oxidanyl)furan-3-one; iron(2+); sulfate Openeye Name: ferrous 2-[(1S)-1,2-dihydroxyethyl]-4,5-dihydroxy-furan-3-one sulfate CAS Name: 2-[(1S)-1,2-dihydroxyethyl]-4,5-dihydroxy-3-furanone; iron(2+); sulfate IUPAC Name: 2-[(1S)-1,2-dihydroxyethyl]-4,5-dihydroxyfuran-3-one; iron(2+); sulfate Traditional Name: ferrous 2-[(1S)-1,2-dihydroxyethyl]-4,5-dihydroxy-furan-3-one sulfate Formula: C6H8FeO10S MolecularWeight: 328.03172

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C1C(=O)C(=C(O1)O)O)O)O.[O-]S(=O)(=O)[O-].[Fe+2]

Isomeric SMILES

C([C@@H](C1C(=O)C(=C(O1)O)O)O)O.[O-]S(=O)(=O)[O-].[Fe+2]

InChI

InChI=1S/C6H8O6.Fe.H2O4S/c7-1-2(8)5-3(9)4(10)6(11)12-5;;1-5(2,3)4/h2,5,7-8,10-11H,1H2;;(H2,1,2,3,4)/q;+2;/p-2/t2-,5?;;/m0../s1