Chem
J-GLOBAL ID：200907096533335516   Nikkaji number：J1.767.719E

N-[1-(1-Carboxy-1-methylethyl)-1H-1,2,3-triazole-4-ylcarbonyl]-3-Boc-Ala-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]-3-Boc-Ala-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： C26H34N6O9
Molecular formula furigana： C26-H34-N6-O9
Molecular weight： 574.591
InChI： InChI=1S/C26H34N6O9/c1-25(2,3)41-20(35)12-17(29-23(38)18-14-32(31-30-18)26(4,5)24(39)40)22(37)28-16(21(36)27-13-19(33)34)11-15-9-7-6-8-10-15/h6-10,14,16-17H,11-13H2,1-5H3,(H,27,36)(H,28,37)(H,29,38)(H,33,34)(H,39,40)/t16-,17-/m0/s1
InChI key： LCNHUFJZHOPKIH-IRXDYDNUSA-N
SMILES： CC(C)(C)OC(=O)C[C@H](NC(=O)c1cn(nn1)C(C)(C)C(=O)O)C(=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]-3-Boc-Ala-Phe-Gly-OH
  • 2-(4-{[(1S)-3-(tert-ブトキシ)-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}-3-オキソプロピル]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)-3-(tert-butoxy)-1-{[(1S)-1-[(carboxymethyl)carbamoyl]-2-phenylethyl]carbamoyl}-3-oxopropyl]carbamoyl}-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]-3-Boc-Ala-Phe-Gly-OH
Thsaurus map：
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