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Substance Name: Cobaltiprotoporphyrin
RN: 14325-03-2
UNII: 63AAN3JDZE
InChIKey: AQTFKGDWFRRIHR-RGGAHWMASA-L

Molecular Formula

  • C34-H30-Co-N4-O4.2H

Molecular Weight

  • 621.6
 
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Names and Synonyms

Name of Substance

  • Cobaltiprotoporphyrin

Synonyms

  • Cobalt protoporphyrin
  • Cobalt protoporphyrin IX
  • NSC 267101
  • UNII-63AAN3JDZE

Systematic Names

  • Cobaltate(2-), (7,12-diethenyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoato(4-)-kappaN21,kappaN22,kappaN23,kappaN24)-, dihydrogen, (SP-4-2)-
  • Cobaltate(2-), (7,12-diethenyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoato(4-)-N21,N22,N23,N24)-, dihydrogen, (SP-4-2)-

Registry Numbers

CAS Registry Number

  • 14325-03-2

FDA UNII

  • 63AAN3JDZE

System Generated Number

  • 0014325032

Molecular Formulas

Molecular Formula

  • C34-H30-Co-N4-O4.2H

Molecular Formula Fragments

  • C34-H30-Co-N4-O4
  • COMPONENT
  • H

Structure Descriptors

InChI

1S/C34H34N4O4.Co/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-2/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-;

InChIKey

AQTFKGDWFRRIHR-RGGAHWMASA-L

Smiles

c12=Cc3[n]4c(c(c3C=C)C)=Cc3c(c(c([n-]3)C=c3[n](c(C=c([n-]1)c(c2C)CCC(=O)[O-])c(CCC(=O)[O-])c3C)[Co+2]4)C)C=C