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Substance Name: Isap-N3
RN: 133190-94-0
InChIKey: KYWKCULJQFXKEZ-HWKANZROSA-N

Note

  • A radioiodinated photoaffinity probe; binds to thromboxane A2 receptors with high affinity.

Molecular Formula

  • C22-H29-I-N4-O4-S

Molecular Weight

  • 572.461
 
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Names and Synonyms

Results Name

  • Isap-N3

Name of Substance

  • 7-(6,6-Dimethyl-3-(4-azido-3-iodobenzenesulfonylamino)bicyclo(3.1.1)hept-2-yl)-5-heptenoic acid

Synonyms

  • (125I)Sap-N3
  • Isap-N3

Systematic Name

  • 5-Heptenoic acid, 7-(3-(((4-azido-3-iodophenyl)sulfonyl)amino)-6,6-dimethylbicyclo(3.1.1)hept-2-yl)-, (IS-(1alpha,2beta(Z),3alpha,5alpha))-

Registry Numbers

CAS Registry Number

  • 133190-94-0

System Generated Number

  • 0133190940

Structure Descriptors

InChI

1S/C22H29IN4O4S/c1-22(2)14-11-17(22)16(7-5-3-4-6-8-21(28)29)20(12-14)26-32(30,31)15-9-10-19(25-27-24)18(23)13-15/h3,5,9-10,13-14,16-17,20,26H,4,6-8,11-12H2,1-2H3,(H,28,29)/b5-3+

InChIKey

KYWKCULJQFXKEZ-HWKANZROSA-N

Smiles

C(CCC\C=C\C[C@@H]1[C@@H]2C([C@@H](C[C@@H]1NS(=O)(=O)c1cc(c(cc1)N=[N+]=[N-])I)C2)(C)C)(=O)O