Chemical Compound

2-{2-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-3-hydroxy-propionylamino}-N-[9-benzyl-6-sec-butyl-12-ethyl-3-(2-methylsulfanyl-ethyl)-2,5,8,11,14-pentaoxo-1-thia-4,7,10,13-tetraaza-cyclohexadec-15-yl]-3-hydroxy-butyramide

2-{2-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-3-hydroxy-propionylamino}-N-[9-benzyl-6-sec-butyl-12-ethyl-3-(2-methylsulfanyl-ethyl)-2,5,8,11,14-pentaoxo-1-thia-4,7,10,13-tetraaza-cyclohexadec-15-yl]-3-hydroxy-butyramide 结构式
Primary record

2-{2-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-3-hydroxy-propionylamino}-N-[9-benzyl-6-sec-butyl-12-ethyl-3-(2-methylsulfanyl-ethyl)-2,5,8,11,14-pentaoxo-1-thia-4,7,10,13-tetraaza-cyclohexadec-15-yl]-3-hydroxy-butyramide

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
44392465
SMILES
CCC1C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)SC[C@@H](C(=O)N1)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC2=CC=C(C=C2)O)N)CCSC)[C@@H](C)CC)CC3=CC=CC=C3
Canonical SMILES
CCC1NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc2ccc(O)cc2)[C@@H](C)O)CSC(=O)[C@@H](CCSC)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@@H](Cc2ccccc2)NC1=O

名称与同义词

  • CHEMBL183830
  • BDBM50151873
  • 2-{2-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-3-hydroxy-propionylamino}-N-[9-benzyl-6-sec-butyl-12-ethyl-3-(2-methylsulfanyl-ethyl)-2,5,8,11,14-pentaoxo-1-thia-4,7,10,13-tetraaza-cyclohexadec-15-yl]-3-hydroxy-butyramide