CymitQuimica logo

CAS 1092540-56-1

:

1,14-Di(methyl-d3) (3S,8S,9S,12S)-3-(1,1-dimethylethyl)-12-[1,1-di(methyl-d3)ethyl-2,2,2-d3]-8-hydroxy-4,11-dioxo-9-(phenylmethyl)-6-[[4-(2-pyridinyl)phenyl]methyl]-2,5,6,10,13-pentaazatetradecanedioate

Description:
1,14-Di(methyl-d3) (3S,8S,9S,12S)-3-(1,1-dimethylethyl)-12-[1,1-di(methyl-d3)ethyl-2,2,2-d3]-8-hydroxy-4,11-dioxo-9-(phenylmethyl)-6-[[4-(2-pyridinyl)phenyl]methyl]-2,5,6,10,13-pentaazatetradecanedioate, with CAS number 1092540-56-1, is a complex organic compound characterized by its multi-functional groups and significant molecular complexity. It features multiple chiral centers, indicating stereochemical specificity, which can influence its biological activity and interactions. The presence of hydroxy, keto, and amine functional groups suggests potential reactivity and solubility in various solvents. The incorporation of isotopic labeling (methyl-d3) allows for tracing and studying metabolic pathways in biological systems. Additionally, the compound's structure includes aromatic rings, which may contribute to its stability and potential interactions with biological targets. Overall, this compound's intricate structure and functional diversity make it a subject of interest in fields such as medicinal chemistry and pharmacology, particularly in the development of therapeutics or as a research tool in biochemical studies.
Formula:C38H37D15N6O7
InChI:InChI=1S/C38H52N6O7/c1-37(2,3)31(41-35(48)50-7)33(46)40-29(22-25-14-10-9-11-15-25)30(45)24-44(43-34(47)32(38(4,5)6)42-36(49)51-8)23-26-17-19-27(20-18-26)28-16-12-13-21-39-28/h9-21,29-32,45H,22-24H2,1-8H3,(H,40,46)(H,41,48)(H,42,49)(H,43,47)/t29-,30-,31+,32+/m0/s1/i1D3,2D3,3D3,7D3,8D3
InChI key:InChIKey=AXRYRYVKAWYZBR-ILCNTUBFSA-N
SMILES:N(CC1=CC=C(C=C1)C2=CC=CC=N2)(C[C@@H]([C@H](CC3=CC=CC=C3)NC([C@@H](NC(OC([2H])([2H])[2H])=O)C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])=O)O)NC([C@@H](NC(OC([2H])([2H])[2H])=O)[C@@](C)(C)C)=O
Synonyms:
  • 1,14-Di(methyl-d3) (3S,8S,9S,12S)-3-(1,1-dimethylethyl)-12-[1,1-di(methyl-d3)ethyl-2,2,2-d3]-8-hydroxy-4,11-dioxo-9-(phenylmethyl)-6-[[4-(2-pyridinyl)phenyl]methyl]-2,5,6,10,13-pentaazatetradecanedioate
  • 2,5,6,10,13-Pentaazatetradecanedioic acid, 3-(1,1-dimethylethyl)-12-[1,1-di(methyl-d3)ethyl-2,2,2-d3]-8-hydroxy-4,11-dioxo-9-(phenylmethyl)-6-[[4-(2-pyridinyl)phenyl]methyl]-, 1,14-di(methyl-d3) ester, (3S,8S,9S,12S)-
Sort by
Purity (%)
0
100
|
0
|
50
|
90
|
95
|
100
Found 1 products.