Chemical Compound

2-{[10-(4-Amino-butyl)-19-(2-amino-3-phenyl-propionylamino)-16-(4-azido-benzyl)-7-(1-hydroxy-ethyl)-13-(1H-indol-3-ylmethyl)-3,3-dimethyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaaza-cycloicosane-4-carbonyl]-amino}-3-hydroxy-butyramide

2-{[10-(4-Amino-butyl)-19-(2-amino-3-phenyl-propionylamino)-16-(4-azido-benzyl)-7-(1-hydroxy-ethyl)-13-(1H-indol-3-ylmethyl)-3,3-dimethyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaaza-cycloicosane-4-carbonyl]-amino}-3-hydroxy-butyramide 结构式
Primary record

2-{[10-(4-Amino-butyl)-19-(2-amino-3-phenyl-propionylamino)-16-(4-azido-benzyl)-7-(1-hydroxy-ethyl)-13-(1H-indol-3-ylmethyl)-3,3-dimethyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaaza-cycloicosane-4-carbonyl]-amino}-3-hydroxy-butyramide

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
73356193
SMILES
CC1([C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(SS1)(C)C)C(=O)O)CC2=CC=C(C=C2)N=[N+]=[N-])NC(=O)[C@H](CC3=CC=C(C=C3)O)N)C
Canonical SMILES
CC1(C)SSC(C)(C)[C@H](C(=O)O)NC(=O)[C@H](Cc2ccc(N=[N+]=[N-])cc2)NC(=O)CNC(=O)[C@H]1NC(=O)[C@@H](N)Cc1ccc(O)cc1

名称与同义词

  • CHEMBL2371216
  • BDBM50016853
  • 2-{[10-(4-Amino-butyl)-19-(2-amino-3-phenyl-propionylamino)-16-(4-azido-benzyl)-7-(1-hydroxy-ethyl)-13-(1H-indol-3-ylmethyl)-3,3-dimethyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaaza-cycloicosane-4-carbonyl]-amino}-3-hydroxy-butyramide