Chem
J-GLOBAL ID:200907024870599800   Nikkaji number:J1.352.914K

5-[(2S,5R)-2-(tert-Butoxycarbonyl)-1-(benzyloxycarbonyl)pyrrolidine-5-yl]-2-(benzyloxycarbonylamino)-2-pentenoic acid methyl ester

5-[(2S,5R)-2-(tert-ブトキシカルボニル)-1-(ベンジルオキシカルボニル)ピロリジン-5-イル]-2-(ベンジルオキシカルボニルアミノ)-2-ペンテン酸メチル
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: C31H38N2O8
Molecular formula furigana: C31-H38-N2-O8
Molecular weight: 566.651
InChI: InChI=1S/C31H38N2O8/c1-31(2,3)41-28(35)26-19-18-24(33(26)30(37)40-21-23-14-9-6-10-15-23)16-11-17-25(27(34)38-4)32-29(36)39-20-22-12-7-5-8-13-22/h5-10,12-15,17,24,26H,11,16,18-21H2,1-4H3,(H,32,36)/t24-,26+/m1/s1
InChI key: APVXUISZSQQJLR-RSXGOPAZSA-N
SMILES: COC(=O)C(=CCC[C@@H]1CC[C@H](N1C(=O)OCc1ccccc1)C(=O)OC(C)(C)C)NC(=O)OCc1ccccc1
Systematic name  (3):
  • 5-[(2S,5R)-2-(tert-ブトキシカルボニル)-1-(ベンジルオキシカルボニル)ピロリジン-5-イル]-2-(ベンジルオキシカルボニルアミノ)-2-ペンテン酸メチル
  • 1-ベンジル 2-tert-ブチル (2S,5R)-5-(4-{[(ベンジルオキシ)カルボニル]アミノ}-5-メトキシ-5-オキソペンタ-3-エン-1-イル)ピロリジン-1,2-ジカルボキシラート
  • 1-benzyl 2-tert-butyl (2S,5R)-5-(4-{[(benzyloxy)carbonyl]amino}-5-methoxy-5-oxopent-3-en-1-yl)pyrrolidine-1,2-dicarboxylate
Other name (1):
  • 5-[(2S,5R)-2-(tert-Butoxycarbonyl)-1-(benzyloxycarbonyl)pyrrolidine-5-yl]-2-(benzyloxycarbonylamino)-2-pentenoic acid methyl ester
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