Chem
J-GLOBAL ID：200907005196523806   Nikkaji number：J1.767.720I

N2-[1-(1-Carboxy-1-methylethyl)-1H-1,2,3-triazole-4-ylcarbonyl]-N4-trityl-Asn-Phe-Gly-OH

N2-[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]-N4-トリチル-Asn-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： C41H41N7O8
Molecular formula furigana： C41-H41-N7-O8
Molecular weight： 759.820
InChI： InChI=1S/C41H41N7O8/c1-40(2,39(55)56)48-26-33(46-47-48)38(54)44-32(37(53)43-31(36(52)42-25-35(50)51)23-27-15-7-3-8-16-27)24-34(49)45-41(28-17-9-4-10-18-28,29-19-11-5-12-20-29)30-21-13-6-14-22-30/h3-22,26,31-32H,23-25H2,1-2H3,(H,42,52)(H,43,53)(H,44,54)(H,45,49)(H,50,51)(H,55,56)/t31-,32-/m0/s1
InChI key： BFYFLZDAEINKFM-ACHIHNKUSA-N
SMILES： CC(C)(C(=O)O)n1cc(nn1)C(=O)N[C@@H](CC(=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O
Systematic name  (3)：
  • N2-[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]-N4-トリチル-Asn-Phe-Gly-OH
  • 2-(4-{[(1S)-1-{[(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}-2-[(トリフェニルメチル)カルバモイル]エチル]カルバモイル}-1H-1,2,3-トリアゾール-1-イル)-2-メチルプロパン酸
  • 2-(4-{[(1S)-1-{[(1S)-1-[(carboxymethyl)carbamoyl]-2-phenylethyl]carbamoyl}-2-[(triphenylmethyl)carbamoyl]ethyl]carbamoyl}-1H-1,2,3-triazol-1-yl)-2-methylpropanoic acid
Other name (1)：
  • N2-[1-(1-Carboxy-1-methylethyl)-1H-1,2,3-triazole-4-ylcarbonyl]-N4-trityl-Asn-Phe-Gly-OH
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