Sodium Ferric Gluconate Complex
sodium;pentakis((2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol);bis(iron(3+));tris(oxygen(2-));(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate
Molecular Identity
Sodium Ferric Gluconate Complex
sodium;pentakis((2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol);bis(iron(3+));tris(oxygen(2-));(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate
PubChem CID: 76968835
2D Structure
Properties
C66H121Fe2NaO65
Molecular Formula
2089.30
Molecular Weight
g/mol
2088.4759
Exact Mass
Da
1090
TPSA
May have limited oral absorption
45
H-Bond Donors
65
H-Bond Acceptors
571
Complexity
SMILES
Canonical SMILES
SMILES: C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)CO)O)O)O)O.C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)CO)O)O)O)O.C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)CO)O)O)O)O.C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)CO)O)O)O)O.C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)CO)O)O)O)O.C(C(C(C(C(C(=O)[O-])O)O)O)O)O.[O-2].[O-2].[O-2].[Na+].[Fe+3].[Fe+3]Isomeric SMILES
SMILES: C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.[O-2].[O-2].[O-2].[Na+].[Fe+3].[Fe+3]Synonyms(18)
ferric sodium gluconateCC9149U2QXUNII-CC9149U2QXsodium ferrigluconateFERRIC NA GLUCONATED-Gluconic acid, iron(3+) sodium saltRefChem:56019DTXCID40110177Gluconic acid, iron(3) sodium salt, D-DTXSID80187686FerrlecitSodium ferric gluconateGluconic acid, iron(3 ) sodium salt, D-OsmoferrinIron sodium gluconate
Data from PubChem (NCBI)
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