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Substance Name: Cortisol-aminopentylethylisoluminol conjugate
RN: 76773-85-8
InChIKey: ARPVYTBUQVLNPO-RHJPVIBVSA-N

Note

  • Chemiluminescent marker for determination of cortisol in human plasma.

Molecular Formula

  • C40-H54-N4-O9

Molecular Weight

  • 734.886
 
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Names and Synonyms

Name of Substance

  • Cortisol-aminopentylethylisoluminol conjugate

Synonym

  • Cortisol-apei conjugate

Systematic Name

  • Pregn-4-ene-3,20-dione, 21-(4-((5-(ethyl(1,2,3,4-tetrahydro-1,4-dioxo-6-phthalazinyl)amino)pentyl)amino)-1,4-dioxobutoxy)-11,17-dihydroxy-, (11beta)-

Registry Numbers

CAS Registry Number

  • 76773-85-8

System Generated Number

  • 0076773858

Structure Descriptors

InChI

1S/C40H54N4O9/c1-4-44(25-9-11-27-29(21-25)37(51)43-42-36(27)50)19-7-5-6-18-41-33(48)12-13-34(49)53-23-32(47)40(52)17-15-30-28-10-8-24-20-26(45)14-16-38(24,2)35(28)31(46)22-39(30,40)3/h9,11,20-21,28,30-31,35,46,52H,4-8,10,12-19,22-23H2,1-3H3,(H,41,48)(H,42,50)(H,43,51)/t28-,30-,31-,35+,38-,39-,40-/m0/s1

InChIKey

ARPVYTBUQVLNPO-RHJPVIBVSA-N

Smiles

C1[C@@]2([C@](CC[C@H]2[C@H]2[C@H]([C@@]3(C(=CC(CC3)=O)CC2)C)[C@H]1O)(C(COC(CCC(NCCCCCN(CC)c1cc2c(c([nH][nH]c2=O)=O)cc1)=O)=O)=O)O)C