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CHEBI:31605 - Ferric citrate (59 Fe)

Default Structure
ChEBI IDCHEBI:31605
ChEBI NameFerric citrate (59 Fe)
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC6H5O7
Net Charge0
Average Mass248.034
Monoisotopic Mass247.93840
SMILESO=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].[59Fe+3]
InChIInChI=1S/C6H8O7.Fe/c7-3(8)1-6(13,5(11)12)2-4(9)10;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);/q;+3/p-3/i;1+3
InChIKeyNPFOYSMITVOQOS-GJNDDOAHSA-K
ChEBI Ontology
Outgoing Relation(s)
Ferric citrate (59 Fe) (CHEBI:31605) is a carbonyl compound (CHEBI:36586)
Synonym  Source
Ferric citrate (59 Fe)KEGG COMPOUND
Manual XrefsDatabases
D02464KEGG DRUG
Registry NumbersSources
CAS:54063-42-2KEGG COMPOUND