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Substance Name: PD 140376
RN: 149027-97-4
InChIKey: ADYHBZJCWPIGJS-FPRYDEEZSA-N

Note

  • A highly selective antagonist radioligand for the cholecystokinin(B)-gastrin receptor in guinea pig cerebral cortex & gastric mucosa.

Molecular Weight

  • 572.702
 
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Names and Synonyms

Name of Substance

  • PD 140376

Synonyms

  • 3-((4-Aminophenyl)methyl)-N-(alpha-methyl-N-((tricyclo(3.3.1.1)dec-2-yloxy)carbonyl)-D-tryptophyl)-beta-alanine
  • PD-140376

Systematic Name

  • Benzenebutanoic acid, 4-amino-beta-((3-(1H-indol-3-yl)-2-methyl-1-oxo-2-(((tricyclo(3.3.1.13,7)dec-2-yloxy)carbonyl)amino)propyl)amino)-, (R-(R*,S*))-

Registry Numbers

CAS Registry Number

  • 149027-97-4

System Generated Number

  • 0149027974

Structure Descriptors

InChI

1S/C33H40N4O5/c1-33(17-24-18-35-28-5-3-2-4-27(24)28,31(40)36-26(16-29(38)39)15-19-6-8-25(34)9-7-19)37-32(41)42-30-22-11-20-10-21(13-22)14-23(30)12-20/h2-9,18,20-23,26,30,35H,10-17,34H2,1H3,(H,36,40)(H,37,41)(H,38,39)/t20?,21?,22?,23?,26-,30?,33+/m0/s1

InChIKey

ADYHBZJCWPIGJS-FPRYDEEZSA-N

Smiles

C12CC3CC(CC(C1)C3)C2OC(N[C@@](C(N[C@@H](Cc1ccc(cc1)N)CC(O)=O)=O)(Cc1c[nH]c2ccccc12)C)=O