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Substance Name: Sodium iron chlorophyllin
RN: 32627-52-4
InChIKey: OGMQNMUHVLRDRT-UHFFFAOYSA-J

Molecular Formula

  • C34-H31-Fe-N4-O6.H.2Na

Molecular Weight

  • 694.474
 
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Names and Synonyms

Results Name

  • Sodium iron chlorophyllin

Synonym

  • Sodium iron chlorophyllin

Systematic Name

  • Ferrate(3-), (18-carboxy-20-(carboxymethyl)-8-ethenyl-13-ethyl-2,3-dihydro-3,7,12,17-tetramethyl-21H,23H-porphine-2-propanato(5-)-N21,N22,N23,N24)-, disodium hydrogen, (SP-4-2-(2S-trans))-

Registry Numbers

CAS Registry Number

  • 32627-52-4

System Generated Number

  • 0032627524

Molecular Formulas

Molecular Formula

  • C34-H31-Fe-N4-O6.H.2Na

Molecular Formula Fragments

  • C34-H31-Fe-N4-O6
  • COMPONENT
  • H
  • Na

Structure Descriptors

InChI

1S/C34H36N4O6.Fe.2Na/c1-7-19-15(3)23-12-25-17(5)21(9-10-29(39)40)32(37-25)22(11-30(41)42)33-31(34(43)44)18(6)26(38-33)14-28-20(8-2)16(4)24(36-28)13-27(19)35-23;;;/h7,12-14,17,21H,1,8-11H2,2-6H3,(H5,35,36,37,38,39,40,41,42,43,44);;;/q;+2;2*+1/p-4

InChIKey

OGMQNMUHVLRDRT-UHFFFAOYSA-J

Smiles

[Fe+2].c1(c(c2[n-]c1c(c1nc([C@@H]([C@@H]1CCC(=O)[O-])C)cc1[n-]c(cc3nc(c2)C(CC)=C3C)c(c1C)C=C)CC(=O)[O-])C)C([O-])=O.[Na+].[Na+]