Chemical Compound

N-[5-[[2-[[2-[[2-[[2-[[2-acetamido-3-(2-naphthyl)propanoyl]amino]-3-(4-chlorophenyl)propanoyl]amino]-3-(3-pyridyl)propanoyl]amino]-3-hydroxy-propanoyl]amino]-6-(pyridine-3-carbonylamino)hexanoyl]amino]-6-[[1-[[1-[2-[(2-amino-1-methyl-2-oxo-ethyl)carbamoyl]pyrrolidine-1-carbonyl]-5-(isopropylamino)pentyl]carbamoyl]-3-methyl-butyl]amino]-6-oxo-hexyl]pyridine-3-carboxamide

CAS Registry Number 112568-12-4
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N-[5-[[2-[[2-[[2-[[2-[[2-acetamido-3-(2-naphthyl)propanoyl]amino]-3-(4-chlorophenyl)propanoyl]amino]-3-(3-pyridyl)propanoyl]amino]-3-hydroxy-propanoyl]amino]-6-(pyridine-3-carbonylamino)hexanoyl]amino]-6-[[1-[[1-[2-[(2-amino-1-methyl-2-oxo-ethyl)carbamoyl]pyrrolidine-1-carbonyl]-5-(isopropylamino)pentyl]carbamoyl]-3-methyl-butyl]amino]-6-oxo-hexyl]pyridine-3-carboxamide 结构式
Primary record

N-[5-[[2-[[2-[[2-[[2-[[2-acetamido-3-(2-naphthyl)propanoyl]amino]-3-(4-chlorophenyl)propanoyl]amino]-3-(3-pyridyl)propanoyl]amino]-3-hydroxy-propanoyl]amino]-6-(pyridine-3-carbonylamino)hexanoyl]amino]-6-[[1-[[1-[2-[(2-amino-1-methyl-2-oxo-ethyl)carbamoyl]pyrrolidine-1-carbonyl]-5-(isopropylamino)pentyl]carbamoyl]-3-methyl-butyl]amino]-6-oxo-hexyl]pyridine-3-carboxamide

库存
3,203 克
纯度
99.7 %
CAS
112568-12-4

化合物标识与属性

CAS
112568-12-4
PubChem CID
176446628
SMILES
CC(C)CC(C(=NC(CCCCNC(C)C)C(=O)N1CCCC1C(=NC(C)C(=N)O)O)O)N=C(C(CCCCN=C(C2=CN=CC=C2)O)N=C(C(CCCCN=C(C3=CN=CC=C3)O)N=C(C(CO)N=C(C(CC4=CN=CC=C4)N=C(C(CC5=CC=C(C=C5)Cl)N=C(C(CC6=CC7=CC=CC=C7C=C6)N=C(C)O)O)O)O)O)O)O
Canonical SMILES
CC(O)=NC(Cc1ccc2ccccc2c1)C(O)=NC(Cc1ccc(Cl)cc1)C(O)=NC(Cc1cccnc1)C(O)=NC(CO)C(O)=NC(CCCCN=C(O)c1cccnc1)C(O)=NC(CCCCN=C(O)c1cccnc1)C(O)=NC(CC(C)C)C(O)=NC(CCCCNC(C)C)C(=O)N1CCCC1C(O)=NC(C)C(=N)O

名称与同义词

  • C82H108ClN17O14
  • MFCD00133104
  • 112568-12-4
  • N-[5-[[2-[[2-[[2-[[2-[[2-acetamido-3-(2-naphthyl)propanoyl]amino]-3-(4-chlorophenyl)propanoyl]amino]-3-(3-pyridyl)propanoyl]amino]-3-hydroxy-propanoyl]amino]-6-(pyridine-3-carbonylamino)hexanoyl]amino]-6-[[1-[[1-[2-[(2-amino-1-methyl-2-oxo-ethyl)carbamoyl]pyrrolidine-1-carbonyl]-5-(isopropylamino)pentyl]carbamoyl]-3-methyl-butyl]amino]-6-oxo-hexyl]pyridine-3-carboxamide