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Substance Name: Ici D1542
RN: 147332-48-7
InChIKey: VGBBXLWOWUXXFE-GWLGBLMRSA-N

Note

  • Redirects arachidonic acid metabolism; an inhibitor of thromboxane A2 synthetase and of thromboxane receptors.

Molecular Weight

  • 470.519
 
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Names and Synonyms

Name of Substance

  • Ici D1542

Synonyms

  • 6-(2-(1-Methyl-1-(2-nitro-4-tolyloxy)ethyl)-4-(3-pyridyl)-1,3-dioxan-5-yl)hex-4-enoic acid
  • D 1542
  • D1542
  • Ici-D1542
  • ZD 1542

Systematic Name

  • 4-Hexenoic acid, 6-(2-(1-methyl-1-(4-methyl-2-nitrophenoxy)ethyl)-4-(3-pyridinyl)-1,3-dioxan-5-yl)-, (2S-(2alpha,4alpha,5alpha(Z)))-

Registry Numbers

CAS Registry Number

  • 147332-48-7

System Generated Number

  • 0147332487

Structure Descriptors

InChI

1S/C25H30N2O7/c1-17-11-12-21(20(14-17)27(30)31)34-25(2,3)24-32-16-19(8-5-4-6-10-22(28)29)23(33-24)18-9-7-13-26-15-18/h4-5,7,9,11-15,19,23-24H,6,8,10,16H2,1-3H3,(H,28,29)/b5-4-/t19-,23-,24+/m1/s1

InChIKey

VGBBXLWOWUXXFE-GWLGBLMRSA-N

Smiles

C(CC\C=C/C[C@H]1[C@H](O[C@H](OC1)C(C)(Oc1c(cc(cc1)C)[N+](=O)[O-])C)c1cnccc1)(=O)O