Chem
J-GLOBAL ID:200907015806173905   Nikkaji number:J1.767.716K

N-[1-(1-Carboxy-1-methylethyl)-1H-1,2,3-triazole-4-ylcarbonyl]-Pro-Phe-Gly-OH

N-[1-(1-カルボキシ-1-メチルエチル)-1H-1,2,3-トリアゾール-4-イルカルボニル]-Pro-Phe-Gly-OH
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: C23H28N6O7
Molecular formula furigana: C23-H28-N6-O7
Molecular weight: 500.512
InChI: InChI=1S/C23H28N6O7/c1-23(2,22(35)36)29-13-16(26-27-29)21(34)28-10-6-9-17(28)20(33)25-15(19(32)24-12-18(30)31)11-14-7-4-3-5-8-14/h3-5,7-8,13,15,17H,6,9-12H2,1-2H3,(H,24,32)(H,25,33)(H,30,31)(H,35,36)/t15-,17-/m0/s1
InChI key: JLKUPNNJSCXFBK-RDJZCZTQSA-N
SMILES: CC(C)(C(=O)O)n1cc(nn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O
Systematic name  (3):
  • N-[1-(1-カルボキシ-1-メチルエチル)-1H-1,2,3-トリアゾール-4-イルカルボニル]-Pro-Phe-Gly-OH
  • 2-{4-[(2S)-2-{[(1S)-1-[(カルボキシメチル)カルバモイル]-2-フェニルエチル]カルバモイル}ピロリジン-1-カルボニル]-1H-1,2,3-トリアゾール-1-イル}-2-メチルプロパン酸
  • 2-{4-[(2S)-2-{[(1S)-1-[(carboxymethyl)carbamoyl]-2-phenylethyl]carbamoyl}pyrrolidine-1-carbonyl]-1H-1,2,3-triazol-1-yl}-2-methylpropanoic acid
Other name (1):
  • N-[1-(1-Carboxy-1-methylethyl)-1H-1,2,3-triazole-4-ylcarbonyl]-Pro-Phe-Gly-OH
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