Chemical Compound

2-[2-Ethyl-4-[2-(acetylamino)-3-oxo-3-[5-oxo-5-[[(1S)-1-carboxy-3-(methylthio)propyl]amino]pentylamino]propyl]phenyl(1,2-dioxo-2-hydroxyethyl)amino]benzoic acid

2-[2-Ethyl-4-[2-(acetylamino)-3-oxo-3-[5-oxo-5-[[(1S)-1-carboxy-3-(methylthio)propyl]amino]pentylamino]propyl]phenyl(1,2-dioxo-2-hydroxyethyl)amino]benzoic acid 结构式
Primary record

2-[2-Ethyl-4-[2-(acetylamino)-3-oxo-3-[5-oxo-5-[[(1S)-1-carboxy-3-(methylthio)propyl]amino]pentylamino]propyl]phenyl(1,2-dioxo-2-hydroxyethyl)amino]benzoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
10055263
SMILES
CCC1=C(C=CC(=C1)CC(C(=O)NCCCCC(=O)N[C@@H](CCSC)C(=O)O)NC(=O)C)N(C2=CC=CC=C2C(=O)O)C(=O)C(=O)O
Canonical SMILES
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)N[C@@H](CCSC)C(=O)O)ccc1N(C(=O)C(=O)O)c1ccccc1C(=O)O

名称与同义词

  • COMPOUND 19
  • CHEMBL55243
  • 1:1 mixture of diastereomers
  • SCHEMBL6495467
  • BDBM15819
  • CID10055263
  • J2.007.259H
  • oxalyl-aryl-amino benzoic acid-based inhibitor 19
  • 2-[(4-{2-[(4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}butyl)carbamoyl]-2-acetamidoethyl}-2-ethylphenyl)amidoformic acid]benzoic acid
  • 2-[1-carboxy-N-(4-{2-[(4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}butyl)carbamoyl]-2-acetamidoethyl}-2-ethylphenyl)formamido]benzoic acid
  • 2-[2-Ethyl-4-[2-(acetylamino)-3-oxo-3-[5-oxo-5-[[(1S)-1-carboxy-3-(methylthio)propyl]amino]pentylamino]propyl]phenyl(1,2-dioxo-2-hydroxyethyl)amino]benzoic acid