Chemical Compound

benzyl N-(1-{1-[(2S)-2-{2-[(2S,3S)-2-{[(tert-butoxy)carbonyl]amino}-N-[(4-methoxyphenyl)methyl]-3-methylpentanamido]-2-methylpropanamido}-3-phenylpropyl]-1H-1,2,3-triazol-4-yl}-1-(diethoxyphosphoryl)-2,2,2-trifluoroethyl)carbamate

benzyl N-(1-{1-[(2S)-2-{2-[(2S,3S)-2-{[(tert-butoxy)carbonyl]amino}-N-[(4-methoxyphenyl)methyl]-3-methylpentanamido]-2-methylpropanamido}-3-phenylpropyl]-1H-1,2,3-triazol-4-yl}-1-(diethoxyphosphoryl)-2,2,2-trifluoroethyl)carbamate 结构式
Primary record

benzyl N-(1-{1-[(2S)-2-{2-[(2S,3S)-2-{[(tert-butoxy)carbonyl]amino}-N-[(4-methoxyphenyl)methyl]-3-methylpentanamido]-2-methylpropanamido}-3-phenylpropyl]-1H-1,2,3-triazol-4-yl}-1-(diethoxyphosphoryl)-2,2,2-trifluoroethyl)carbamate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
101553295
SMILES
CC[C@H](C)[C@@H](C(=O)N(CC1=CC=C(C=C1)OC)C(C)(C)C(=O)N[C@@H](CC2=CC=CC=C2)CN3C=C(N=N3)C(C(F)(F)F)(NC(=O)OCC4=CC=CC=C4)P(=O)(OCC)OCC)NC(=O)OC(C)(C)C
Canonical SMILES
CCOP(=O)(OCC)C(NC(=O)OCc1ccccc1)(c1cn(C[C@H](Cc2ccccc2)NC(=O)C(C)(C)N(Cc2ccc(OC)cc2)C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)nn1)C(F)(F)F

名称与同义词

  • J3.029.379G
  • [1-[1-[(S)-2-[[2-Methyl-2-[(4-methoxybenzyl)[N-(tert-butyloxycarbonyl)-L-isoleucyl]amino]propanoyl]amino]-3-phenylpropyl]-1H-1,2,3-triazole-4-yl]-1-[(benzyloxycarbonyl)amino]-2,2,2-trifluoroethyl]phosphonic acid diethyl ester
  • benzyl N-(1-{1-[(2S)-2-{2-[(2S,3S)-2-{[(tert-butoxy)carbonyl]amino}-N-[(4-methoxyphenyl)methyl]-3-methylpentanamido]-2-methylpropanamido}-3-phenylpropyl]-1H-1,2,3-triazol-4-yl}-1-(diethoxyphosphoryl)-2,2,2-trifluoroethyl)carbamate