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Substance Name: Cgp 45715A
RN: 125617-94-9
InChIKey: UVMDAJYLEKEIPJ-RWRWEHELSA-M

Note

  • Has potent peptido-leukotriene antagonist activity.

Molecular Formula

  • C38-H37-F3-O8-S.Na

Molecular Weight

  • 732.744
 
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Names and Synonyms

Name of Substance

  • Cgp 45715A

Synonyms

  • (S-(R*,S*-(E,Z)))-7-((9-(4-Acetyl-3-hydroxy-2-propylphenoxy)-1-(hydroxy(3-(trifluoromethyl)phenyl)methyl)-2,4-nonadienyl)thio)-4-oxo-4H-1-benzopyran-2-carboxylic acid monosodium salt
  • 1-Hydroxy-1-(3-trifluoromethylphenyl)-10-(4-acetyl-3-hydroxy-2-propylphenoxy)deca-3(E),5(Z)-diene-2-yl-7-thio-4-oxo-4H-1-benzopyran-2-carboxylic acid
  • Cgp-45715 A

Systematic Name

  • 4H-1-Benzopyran-2-carboxylic acid, 7-((9-(4-acetyl-3-hydroxy-2-propylphenoxy)-1-(hydroxy(3-(trifluoromethyl)phenyl)methyl)-2,4-nonadienyl)thio)-4-oxo-, monosodium salt, (S-(R*,S*-(E,Z)))-

Registry Numbers

CAS Registry Number

  • 125617-94-9

System Generated Number

  • 0125617949

Molecular Formulas

Molecular Formula

  • C38-H37-F3-O8-S.Na

Molecular Formula Fragments

  • C38-H37-F3-O8-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C38H37F3O8S.Na/c1-3-11-29-31(18-17-27(23(2)42)36(29)45)48-19-9-7-5-4-6-8-14-34(35(44)24-12-10-13-25(20-24)38(39,40)41)50-26-15-16-28-30(43)22-33(37(46)47)49-32(28)21-26;/h4,6,8,10,12-18,20-22,34-35,44-45H,3,5,7,9,11,19H2,1-2H3,(H,46,47);/q;+1/p-1/b6-4-,14-8+;/t34-,35+;/m0./s1

InChIKey

UVMDAJYLEKEIPJ-RWRWEHELSA-M

Smiles

[Na+].c1(cc(c2c(o1)cc(cc2)S[C@@H](\C=C\C=C/CCCCOc1c(c(c(cc1)C(=O)C)O)CCC)[C@@H](c1cc(ccc1)C(F)(F)F)O)=O)C(=O)[O-]