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Substance Name: tert-Butyloxycarbonyl-tryptophyl-benzyloxycarbonyl-ornithyl-aspartamide
RN: 129594-05-4
InChIKey: LEKFBJJCGXWLRR-GSDHBNRESA-N

Note

  • Cholecystokinin antagonist.

Molecular Weight

  • 666.7278
 
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Names and Synonyms

Name of Substance

  • tert-Butyloxycarbonyl-tryptophyl-benzyloxycarbonyl-ornithyl-aspartamide

Synonym

  • Boc-trp-orn(Z)-asp-NH2

Registry Numbers

CAS Registry Number

  • 129594-05-4

System Generated Number

  • 0129594054

Structure Descriptors

InChI

1S/C33H42N6O9/c1-33(2,3)48-32(46)39-25(16-21-18-36-23-13-8-7-12-22(21)23)29(42)37-24(28(41)38-26(30(43)44)17-27(34)40)14-9-15-35-31(45)47-19-20-10-5-4-6-11-20/h4-8,10-13,18,24-26,36H,9,14-17,19H2,1-3H3,(H2,34,40)(H,35,45)(H,37,42)(H,38,41)(H,39,46)(H,43,44)/t24-,25-,26-/m0/s1

InChIKey

LEKFBJJCGXWLRR-GSDHBNRESA-N

Smiles

CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N[C@@H](CCCNC(=O)OCc3ccccc3)C(=O)N[C@@H](CC(=O)N)C(=O)O