IUPAC Name :iron(2+); (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate; dihydrate
InChI :InChI=1/2C6H12O7.Fe.2H2O/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;;;/h2*2-5,7-11H,1H2,(H,12,13);;2*1H2/q;;+2;;/p-2/t2*2-,3-,4+,5-;;;/m11.../s1
Std.InChI: InChI=1S/2C6H12O7.Fe.2H2O/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;;;/h2*2-5,7-11H,1H2,(H,12,13);;2*1H2/q;;+2;;/p-2/t2*2-,3-,4+,5-;;;/m11.../s1
InChIKey :OKGNXSFAYMSVNN-XOHHGACYBL
Std.InChIKey: OKGNXSFAYMSVNN-SYAJEJNSSA-L
SMILES :C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.O.O.[Fe+2]
MDL: MFCD00150872