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Substance Name: N(alpha)-(N(alpha)-(N(alpha)-(tert-Butyloxycarbonyl)glutaminyl)-N(1)-formyl-tryptophyl)phenylalanine benzyl ester
RN: 126088-82-2
InChIKey: ZFZOHFAASQHWER-YPKYBTACSA-N

Note

  • Potent substance P antagonist.

Molecular Formula

  • C38-H43-N5-O8

Molecular Weight

  • 697.785
 
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Names and Synonyms

Name of Substance

  • N(alpha)-(N(alpha)-(N(alpha)-(tert-Butyloxycarbonyl)glutaminyl)-N(1)-formyl-tryptophyl)phenylalanine benzyl ester

Synonyms

  • Bgtcpo
  • Boc-gln-trp(cho)-phe-obzl
  • N-(N-(N2-((1,1-Dimethylethoxy)carbonyl)-L-glutaminyl)-1-formyl-D-tryptophyl)-L-phenylalanine phenylmethyl ester

Systematic Name

  • L-Phenylalanine, N-(N-(N2-((1,1-dimethylethoxy)carbonyl)-L-glutaminyl)-1-formyl-D-tryptophyl)-, phenylmethyl ester

Registry Numbers

CAS Registry Number

  • 126088-82-2

System Generated Number

  • 0126088822

Structure Descriptors

InChI

1S/C38H43N5O8/c1-38(2,3)51-37(49)42-29(18-19-33(39)45)34(46)40-30(21-27-22-43(24-44)32-17-11-10-16-28(27)32)35(47)41-31(20-25-12-6-4-7-13-25)36(48)50-23-26-14-8-5-9-15-26/h4-17,22,24,29-31H,18-21,23H2,1-3H3,(H2,39,45)(H,40,46)(H,41,47)(H,42,49)/t29-,30+,31-/m0/s1

InChIKey

ZFZOHFAASQHWER-YPKYBTACSA-N

Smiles

C([C@@H](NC([C@H](NC([C@@H](NC(=O)OC(C)(C)C)CCC(=O)N)=O)Cc1cn(c2ccccc12)C=O)=O)Cc1ccccc1)(=O)OCc1ccccc1