2-(chloromethyl)oxirane; iron(3+); (2R,3S,4R,5R)-2,3,4,5,6-pentakis(oxidanyl)hexanoic acid; (2S,3R,4S,5R)-4,5,6-tris(oxidanyl)hexane-1,2,3-triolate

Systemtic Name: 2-(chloromethyl)oxirane; iron(3+); (2R,3S,4R,5R)-2,3,4,5,6-pentakis(oxidanyl)hexanoic acid; (2S,3R,4S,5R)-4,5,6-tris(oxidanyl)hexane-1,2,3-triolate Openeye Name: ferric; 2-(chloromethyl)oxirane; (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid; (2S,3R,4S,5R)-4,5,6-trihydroxyhexane-1,2,3-triolate CAS Name: 2-(chloromethyl)oxirane; iron(3+); (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid; (2S,3R,4S,5R)-4,5,6-trihydroxyhexane-1,2,3-triolate IUPAC Name: 2-(chloromethyl)oxirane; iron(3+); (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid; (2S,3R,4S,5R)-4,5,6-trihydroxyhexane-1,2,3-triolate Traditional Name: ferric; 2-(chloromethyl)oxirane; (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid; (2S,3R,4S,5R)-4,5,6-trihydroxyhexane-1,2,3-triolate Formula: C15H28ClFeO14 MolecularWeight: 523.67242

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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)CCl.C(C(C(C(C(C(=O)O)O)O)O)O)O.C(C(C(C(C(C[O-])[O-])[O-])O)O)O.[Fe+3]

Isomeric SMILES

C1C(O1)CCl.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.[Fe+3]

InChI

InChI=1S/C6H12O7.C6H11O6.C3H5ClO.Fe/c7-1-2(8)3(9)4(10)5(11)6(12)13;7-1-3(9)5(11)6(12)4(10)2-8;4-1-3-2-5-3;/h2-5,7-11H,1H2,(H,12,13);3-7,9,11H,1-2H2;3H,1-2H2;/q;-3;;+3/t2-,3-,4+,5-;3-,4+,5-,6-;;/m11../s1