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CAS 118359-59-4

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N-[2-[[2-[[(1aS,8S,8aR,8bS)-8-[[(Aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2′,3′:3,4]pyrrolo[1,2-a]indol-6-yl]amino]ethyl]dithio]ethyl]-L-glutamine

Description:
N-[2-[[2-[[(1aS,8S,8aR,8bS)-8-[[(Aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2′,3′:3,4]pyrrolo[1,2-a]indol-6-yl]amino]ethyl]dithio]ethyl]-L-glutamine is a complex organic compound characterized by its intricate molecular structure, which includes multiple functional groups and stereocenters. This substance features a glutamine moiety, which is an amino acid known for its role in protein synthesis and metabolism. The presence of dithio and aminocarbonyl groups suggests potential reactivity and biological activity, possibly influencing its pharmacological properties. The compound's stereochemistry, indicated by the specific configuration at various chiral centers, may significantly affect its interactions with biological targets. Additionally, the presence of a methoxy group and a dioxo structure may contribute to its stability and solubility in various solvents. Overall, this compound's unique characteristics make it a subject of interest in medicinal chemistry and drug development, particularly in the context of its potential therapeutic applications.
Formula:C24H34N6O8S2
InChI:InChI=1S/C24H34N6O8S2/c1-11-17(28-6-8-40-39-7-5-27-15(31)4-3-13(25)22(34)35)20(33)16-12(10-38-23(26)36)24(37-2)21-14(29-21)9-30(24)18(16)19(11)32/h12-14,21,28-29H,3-10,25H2,1-2H3,(H2,26,36)(H,27,31)(H,34,35)/t12-,13+,14+,21+,24-/m1/s1
InChI key:InChIKey=BIOSTZMAOGCGSC-CYUGEGSCSA-N
SMILES:O(C)[C@]12N(C3=C([C@H]1COC(N)=O)C(=O)C(NCCSSCCNC(CC[C@@H](C(O)=O)N)=O)=C(C)C3=O)C[C@]4([C@@]2(N4)[H])[H]
Synonyms:
  • L-Glutamine, N-[2-[[2-[[8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2′,3′:3,4]pyrrolo[1,2-a]indol-6-yl]amino]ethyl]dithio]ethyl]-, [1aS-(1aα,8β,8aα,8bα)]-
  • N-[2-[[2-[[(1aS,8S,8aR,8bS)-8-[[(Aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2′,3′:3,4]pyrrolo[1,2-a]indol-6-yl]amino]ethyl]dithio]ethyl]-L-glutamine
  • KW 2149
  • L-Glutamine, N-[2-[[2-[[(1aS,8S,8aR,8bS)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2′,3′:3,4]pyrrolo[1,2-a]indol-6-yl]amino]ethyl]dithio]ethyl]-
  • Azirino[2′,3′:3,4]pyrrolo[1,2-a]indole, L-glutamine deriv.
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