magnesium [(5R)-5-[(1S)-1,2-bis(oxidanyl)ethyl]-2-oxidanyl-4-oxidanylidene-furan-3-yl] sulfate

Systemtic Name: magnesium [(5R)-5-[(1S)-1,2-bis(oxidanyl)ethyl]-2-oxidanyl-4-oxidanylidene-furan-3-yl] sulfate Openeye Name: magnesium [(5R)-5-[(1S)-1,2-dihydroxyethyl]-2-hydroxy-4-oxo-3-furyl] sulfate CAS Name: magnesium [(5R)-5-[(1S)-1,2-dihydroxyethyl]-2-hydroxy-4-oxo-3-furanyl] sulfate IUPAC Name: magnesium [(5R)-5-[(1S)-1,2-dihydroxyethyl]-2-hydroxy-4-oxofuran-3-yl] sulfate Traditional Name: magnesium [(5R)-5-[(1S)-1,2-dihydroxyethyl]-2-hydroxy-4-keto-3-furyl] sulfate Formula: C12H14MgO18S2 MolecularWeight: 534.66376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C(C1C(=O)C(=C(O1)O)OS(=O)(=O)[O-])O)O.C(C(C1C(=O)C(=C(O1)O)OS(=O)(=O)[O-])O)O.[Mg+2]

Isomeric SMILES

C([C@@H]([C@@H]1C(=O)C(=C(O1)O)OS(=O)(=O)[O-])O)O.C([C@@H]([C@@H]1C(=O)C(=C(O1)O)OS(=O)(=O)[O-])O)O.[Mg+2]

InChI

InChI=1S/2C6H8O9S.Mg/c2*7-1-2(8)4-3(9)5(6(10)14-4)15-16(11,12)13;/h2*2,4,7-8,10H,1H2,(H,11,12,13);/q;;+2/p-2/t2*2-,4+;/m00./s1