Chemical Compound

(3S)-5-(benzylsulfanyl)-3-{[(2S,11S)-11-[(3S)-3-acetamido-3-formamidopropanoic acid]-12-oxo-1-azatricyclo[6.4.1.0^{4,13}]trideca-4(13),5,7-trien-2-yl]formamido}-4-oxopentanoic acid

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(3S)-5-(benzylsulfanyl)-3-{[(2S,11S)-11-[(3S)-3-acetamido-3-formamidopropanoic acid]-12-oxo-1-azatricyclo[6.4.1.0^{4,13}]trideca-4(13),5,7-trien-2-yl]formamido}-4-oxopentanoic acid 结构式
Primary record

(3S)-5-(benzylsulfanyl)-3-{[(2S,11S)-11-[(3S)-3-acetamido-3-formamidopropanoic acid]-12-oxo-1-azatricyclo[6.4.1.0^{4,13}]trideca-4(13),5,7-trien-2-yl]formamido}-4-oxopentanoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
5287496
SMILES
CC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H]1CCC2=C3C(=CC=C2)C[C@H](N3C1=O)C(=O)N[C@@H](CC(=O)O)C(=O)CSCC4=CC=CC=C4
Canonical SMILES
CC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H]1CCc2cccc3c2N(C1=O)[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)C3

名称与同义词

  • compound 4
  • BDBM10654
  • CID5287496
  • CID 5287496
  • PD193808
  • 5,6,7 TRICYCLIC PEPTIDOMIMETIC INHIBITOR
  • Q27453714
  • (3S)-3-[({(2S)-5-[(N-ACETYL-L-ALPHA-ASPARTYL)AMINO]-4-OXO-1,2,4,5,6,7-HEXAHYDROAZEPINO[3,2,1-HI]INDOL-2-YL}CARBONYL)AMINO]-5-(BENZYLSULFANYL)-4-OXOPENTANOIC ACID
  • (3S)-3-[({(2S,5S)-5-[(N-acetyl-L-alpha-aspartyl)amino]-4-oxo-1,2,4,5,6,7-hexahydroazepino[3,2,1-hi]indol-2-yl}carbonyl)amino]-5-(benzylsulfanyl)-4-oxopentanoic acid
  • (3S)-5-(benzylsulfanyl)-3-{[(2S,11S)-11-[(3S)-3-acetamido-3-formamidopropanoic acid]-12-oxo-1-azatricyclo[6.4.1.0^{4,13}]trideca-4(13),5,7-trien-2-yl]formamido}-4-oxopentanoic acid
  • 3CY