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Substance Name: Ferrienterochelin
RN: 62280-34-6
InChIKey: NGILTSZTOFYVBF-UHFFFAOYSA-K

Note

  • Ferric ion enterochelin complex.

Molecular Weight

  • 722.3706
 
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Names and Synonyms

Name of Substance

  • Ferrienterochelin

Synonyms

  • Ferrate(3-), ((N,N',N''-(2,6,10-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl)tris(2,3-dihydroxybenzamidato))(6-)-O2,O2',O2'',O3,O3',O3'')-, trihydrogen, stereoisomer
  • Ferric enterochelin

Systematic Name

  • Ferrate(3-), ((N,N',N''-(2,6,10-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl)tris(2,3-dihydroxybenzamidato))(6-)-O2,O2',O2'',O3,O3',O3'')-, trihydrogen, (OC-6-22-(3S-(3R*,7R*,11R*)))-

Registry Numbers

CAS Registry Number

  • 62280-34-6

System Generated Number

  • 0062280346

Structure Descriptors

InChI

InChI=1S/C30H27N3O15.Fe/c34-19-7-1-4-13(22(19)37)25(40)31-16-10-46-29(44)18(33-27(42)15-6-3-9-21(36)24(15)39)12-48-30(45)17(11-47-28(16)43)32-26(41)14-5-2-8-20(35)23(14)38;/h1-9,16-18,34-39H,10-12H2,(H,31,40)(H,32,41)(H,33,42);/q;+3/p-3

InChIKey

NGILTSZTOFYVBF-UHFFFAOYSA-K

Smiles

[H+].[H+].[H+].[Fe+3].[O-]c1cccc(C(=O)NC2COC(=O)C(COC(=O)C(COC2=O)NC(=O)c3cccc([O-])c3[O-])NC(=O)c4cccc([O-])c4[O-])c1[O-]