CAS 130332-27-3

4-[[(1R)-2-[[(2R)-3-(1H-Indol-3-yl)-2-methyl-1-oxo-2-[[(tricyclo[3.3.1.13,7]dec-2-yloxy)carbonyl]amino]propyl]amino]-1-phenylethyl]amino]-4-oxobutanoic acid

Description:

The chemical substance known as 4-[[[1R]-2-[[(2R)-3-(1H-Indol-3-yl)-2-methyl-1-oxo-2-[[(tricyclo[3.3.1.13,7]dec-2-yloxy)carbonyl]amino]propyl]amino]-1-phenylethyl]amino]-4-oxobutanoic acid, with the CAS number 130332-27-3, is a complex organic compound characterized by its intricate molecular structure, which includes multiple functional groups such as amines, carbonyls, and an indole moiety. This compound exhibits properties typical of bioactive molecules, potentially influencing biological pathways due to its structural features. The presence of the tricyclic structure may contribute to its pharmacological activity, while the oxobutanoic acid component suggests potential interactions with metabolic processes. Its stereochemistry, indicated by the (R) configurations, is crucial for its biological activity, as chirality can significantly affect the interaction with biological targets. Overall, this compound's unique characteristics make it of interest in medicinal chemistry and drug development, although specific biological activities and applications would require further investigation.

Formula: C₃₅H₄₂N₄O₆

InChI: InChI=1S/C35H42N4O6/c1-35(18-26-19-36-28-10-6-5-9-27(26)28,39-34(44)45-32-24-14-21-13-22(16-24)17-25(32)15-21)33(43)37-20-29(23-7-3-2-4-8-23)38-30(40)11-12-31(41)42/h2-10,19,21-22,24-25,29,32,36H,11-18,20H2,1H3,(H,37,43)(H,38,40)(H,39,44)(H,41,42)/t21?,22?,24?,25?,29-,32?,35+/m0/s1

InChI key: InChIKey=FVQSSYMRZKLFDR-ZABPBAJSSA-N

SMILES: O(C(N[C@](CC=1C=2C(NC1)=CC=CC2)(C(NC[C@H](NC(CCC(O)=O)=O)C3=CC=CC=C3)=O)C)=O)C4C5CC6CC4CC(C5)C6

Synonyms:

• 4-[[(1R)-2-[[(2R)-3-(1H-Indol-3-yl)-2-methyl-1-oxo-2-[[(tricyclo[3.3.1.1^3,7]dec-2-yloxy)carbonyl]amino]propyl]amino]-1-phenylethyl]amino]-4-oxobutanoic acid
• 4-{[(1R)-2-({N-[(Adamantan-2-yloxy)carbonyl]-alpha-methyl-D-tryptophyl}amino)-1-phenylethyl]amino}-4-oxobutanoic acid
• Butanoic acid, 4-[[(1R)-2-[[(2R)-3-(1H-indol-3-yl)-2-methyl-1-oxo-2-[[(tricyclo[3.3.1.1^3,7]dec-2-yloxy)carbonyl]amino]propyl]amino]-1-phenylethyl]amino]-4-oxo-
• Butanoic acid, 4-[[(1R)-2-[[(2R)-3-(1H-indol-3-yl)-2-methyl-1-oxo-2-[[(tricyclo[3.3.1.1~3,7~]dec-2-yloxy)carbonyl]amino]propyl]amino]-1-phenylethyl]amino]-4-oxo-
• Butanoic acid, 4-[[2-[[3-(1H-indol-3-yl)-2-methyl-1-oxo-2-[[(tricyclo[3.3.1.1^3,7]dec-2-yloxy)carbonyl]amino]propyl]amino]-1-phenylethyl]amino]-4-oxo-, [R-(R*,R*)]-
• [R-(R^*,R^*)]-4-[[2-[[3-(1H-Indol-3-yl)-2-methyl-1-oxo-2-[[(tricyclo[3.3.1.1^3,7]dec-2-yloxy)carbonyl]amino]propyl]amino]-1-phenylethyl]amino]-4-oxobutanoic acid
• Butanoic acid, 4-[[(1R)-2-[[(2R)-3-(1H-indol-3-yl)-2-methyl-1-oxo-2-[[(tricyclo[3.3.1.13,7]dec-2-yloxy)carbonyl]amino]propyl]amino]-1-phenylethyl]amino]-4-oxo-
• 4-[[(1R)-2-[[(2R)-3-(1H-Indol-3-yl)-2-methyl-1-oxo-2-[[(tricyclo[3.3.1.13,7]dec-2-yloxy)carbonyl]amino]propyl]amino]-1-phenylethyl]amino]-4-oxobutanoic acid
• [R-(R*,R*)]-4-[[2-[[3-(1H-Indol-3-yl)-2-methyl-1-oxo-2-[[(tricyclo[3.3.1.13,7]dec-2-yloxy)carbonyl]amino]propyl]amino]-1-phenylethyl]amino]-4-oxobutanoic acid
• Butanoic acid, 4-[[2-[[3-(1H-indol-3-yl)-2-methyl-1-oxo-2-[[(tricyclo[3.3.1.13,7]dec-2-yloxy)carbonyl]amino]propyl]amino]-1-phenylethyl]amino]-4-oxo-, [R-(R*,R*)]-

CI-988

CAS: 130332-27-3

Formula: C₃₅H₄₂N₄O₆

Purity: 98%

Molecular weight: 614.7312

Ref: IN-DA00806N

CI 988

CAS: 130332-27-3

CholecystokininB (CCKB) receptor antagonist

Formula: C₃₅H₄₂N₄O₆

Purity: Min. 95%

Molecular weight: 614.73 g/mol

Ref: 3D-FC20426

CI-988

Controlled Product

CAS: 130332-27-3

Formula: C₃₅H₄₂N₄O₆

Color and Shape: Neat

Molecular weight: 614.731

Ref: TR-C432695

CI-988

CAS: 130332-27-3

CCK2 (CCK-B) receptor antagonist

Formula: C₃₅H₄₂N₄O₆

Purity: 98%

Color and Shape: Solid

Molecular weight: 614.73

Ref: TM-T22666