Chem
J-GLOBAL ID:200907043869396347   Nikkaji number:J2.449.580I

Nα,Nα′-[1-(4-Pyridyl)pyrrolidine-2α,5β-diylbiscarbonyl]bis(tryptophan octyl) ester

Nα,Nα′-[1-(4-ピリジル)ピロリジン-2α,5β-ジイルビスカルボニル]ビス(トリプトファンオクチル)
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C49H64N6O6
Molecular formula furigana: C49-H64-N6-O6
Molecular weight: 833.087
InChI: InChI=1S/C49H64N6O6/c1-3-5-7-9-11-17-29-60-48(58)42(31-35-33-51-40-21-15-13-19-38(35)40)53-46(56)44-23-24-45(55(44)37-25-27-50-28-26-37)47(57)54-43(49(59)61-30-18-12-10-8-6-4-2)32-36-34-52-41-22-16-14-20-39(36)41/h13-16,19-22,25-28,33-34,42-45,51-52H,3-12,17-18,23-24,29-32H2,1-2H3,(H,53,56)(H,54,57)/t42-,43-,44-,45-/m0/s1
InChI key: HGTRVHNYZINJPH-HRBFTXTFSA-N
SMILES: CCCCCCCCOC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](N1c1ccncc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCCCCCCC
Systematic name  (24):
  • Nα-[[(2S,5S)-1-(4-ピリジル)-5-[[(1S)-1-(オクチルオキシカルボニル)-2-(1H-インドール-3-イル)エチル]カルバモイル]ピロリジン]-2-イルカルボニル]-L-トリプトファンオクチル
  • (2S)-N,N′-ビス[(S)-1-(オクチルオキシカルボニル)-2-(1H-インドール-3-イル)エチル]-1-(4-ピリジニル)ピロリジン-2α,5β-ジカルボアミド
  • Nα,Nα′-[1-(4-ピリジル)ピロリジン-2α,5β-ジイルビスカルボニル]ビス(トリプトファンオクチル)
  • Nα,Nα′-[[1-(4-ピリジニル)ピロリジン-2α,5β-ジイル]ビスカルボニル]ビス(L-トリプトファンオクチル)
  • Nα,Nα′-[1-(4-ピリジル)ピロリジン-2α,5β-ジイルビスカルボニル]ビス(L-トリプトファンオクチル)
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Other name (22):
  • Nα-[[(2S,5S)-1-(4-Pyridyl)-5-[[(1S)-1-(octyloxycarbonyl)-2-(1H-indole-3-yl)ethyl]carbamoyl]pyrrolidine]-2-ylcarbonyl]-L-tryptophan octyl ester
  • (2S)-N,N′-Bis[(S)-1-(octyloxycarbonyl)-2-(1H-indole-3-yl)ethyl]-1-(4-pyridinyl)pyrrolidine-2α,5β-dicarboxamide
  • Nα,Nα′-[1-(4-Pyridyl)pyrrolidine-2α,5β-diylbiscarbonyl]bis(tryptophan octyl) ester
  • Nα,Nα′-[[1-(4-Pyridinyl)pyrrolidine-2α,5β-diyl]biscarbonyl]bis(L-tryptophan octyl) ester
  • Nα,Nα′-[1-(4-Pyridyl)pyrrolidine-2α,5β-diylbiscarbonyl]bis(L-tryptophan octyl) ester
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