Chemical Compound

(2S)-N-[(2S,3R)-3-[6-[(2R,3S)-4-[(2S)-2-[[[(1Z,3Z)-hexa-1,3,5-trienyl]-(2,2,2-trifluoroacetyl)amino]methyl]pyrrolidin-1-yl]-3-[[(2S)-2-(methylamino)propanoyl]amino]-4-oxobutan-2-yl]oxyhexa-2,4-diynoxy]-1-oxo-1-[(2S)-2-[[2-phenylethyl-(2,2,2-trifluoroacetyl)amino]methyl]pyrrolidin-1-yl]butan-2-yl]-2-(methylamino)propanamide

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(2S)-N-[(2S,3R)-3-[6-[(2R,3S)-4-[(2S)-2-[[[(1Z,3Z)-hexa-1,3,5-trienyl]-(2,2,2-trifluoroacetyl)amino]methyl]pyrrolidin-1-yl]-3-[[(2S)-2-(methylamino)propanoyl]amino]-4-oxobutan-2-yl]oxyhexa-2,4-diynoxy]-1-oxo-1-[(2S)-2-[[2-phenylethyl-(2,2,2-trifluoroacetyl)amino]methyl]pyrrolidin-1-yl]butan-2-yl]-2-(methylamino)propanamide 结构式
Primary record

(2S)-N-[(2S,3R)-3-[6-[(2R,3S)-4-[(2S)-2-[[[(1Z,3Z)-hexa-1,3,5-trienyl]-(2,2,2-trifluoroacetyl)amino]methyl]pyrrolidin-1-yl]-3-[[(2S)-2-(methylamino)propanoyl]amino]-4-oxobutan-2-yl]oxyhexa-2,4-diynoxy]-1-oxo-1-[(2S)-2-[[2-phenylethyl-(2,2,2-trifluoroacetyl)amino]methyl]pyrrolidin-1-yl]butan-2-yl]-2-(methylamino)propanamide

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
143447886
SMILES
C[C@H]([C@@H](C(=O)N1CCC[C@H]1CN(CCC2=CC=CC=C2)C(=O)C(F)(F)F)NC(=O)[C@H](C)NC)OCC#CC#CCO[C@H](C)[C@@H](C(=O)N3CCC[C@H]3CN(/C=C\C=C/C=C)C(=O)C(F)(F)F)NC(=O)[C@H](C)NC
Canonical SMILES
C=C/C=C\C=C/N(C[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)[C@@H](C)OCC#CC#CCO[C@H](C)[C@H](NC(=O)[C@H](C)NC)C(=O)N1CCC[C@H]1CN(CCc1ccccc1)C(=O)C(F)(F)F)C(=O)C(F)(F)F

名称与同义词

  • OATNZAGJDWVOML-ZNKURVDWSA-N
  • (2S)-N-[(2S,3R)-3-[6-[(2R,3S)-4-[(2S)-2-[[[(1Z,3Z)-hexa-1,3,5-trienyl]-(2,2,2-trifluoroacetyl)amino]methyl]pyrrolidin-1-yl]-3-[[(2S)-2-(methylamino)propanoyl]amino]-4-oxobutan-2-yl]oxyhexa-2,4-diynoxy]-1-oxo-1-[(2S)-2-[[2-phenylethyl-(2,2,2-trifluoroacetyl)amino]methyl]pyrrolidin-1-yl]butan-2-yl]-2-(methylamino)propanamide