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Substance Name: Nitrosylprotoheme
RN: 54854-55-6
InChIKey: QUOUCVKVLWFSKT-HXFTUNQESA-L

Note

  • From reaction of nitrite & heme.

Molecular Weight

  • 646.502
 
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Names and Synonyms

Name of Substance

  • Nitrosylprotoheme

Synonyms

  • Nitrosoheme
  • Nitrosylferroheme
  • Nitrosylheme
  • Nitrosylprotohaem

Systematic Name

  • Ferrate(2-), (7,12-diethenyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoato(4-)-N21,N22,N23,N24)nitrosyl-, dihydrogen, (SP-5-13)-

Registry Numbers

CAS Registry Number

  • 54854-55-6

System Generated Number

  • 0054854556

Structure Descriptors

InChI

1S/C34H34N4O4.Fe.NO/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;;1-2/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);;/q;2*+1/p-2/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-;;

InChIKey

QUOUCVKVLWFSKT-HXFTUNQESA-L

Smiles

[Fe+].N#[O+].C=1(c2cc3c(c(c([n-]3)cc3nc(cc4[n-]c(cc(C1C)n2)c(c4C=C)C)C(C)=C3C=C)C)CCC([O-])=O)CCC([O-])=O