Chemical Compound

(3S,6S,9R,12S,15S,23S)-6-(3-carbamimidamidopropyl)-15-[(2S)-2-acetamidohexanamido]-12-[(1H-imidazol-4-yl)methyl]-3-[(1H-indol-3-yl)methyl]-9-[(naphthalen-2-yl)methyl]-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,18-hexaazacyclotricosane-23-carboxamide

CAS Registry Number 168482-23-3
返回搜索 申请报价
(3S,6S,9R,12S,15S,23S)-6-(3-carbamimidamidopropyl)-15-[(2S)-2-acetamidohexanamido]-12-[(1H-imidazol-4-yl)methyl]-3-[(1H-indol-3-yl)methyl]-9-[(naphthalen-2-yl)methyl]-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,18-hexaazacyclotricosane-23-carboxamide 结构式
Primary record

(3S,6S,9R,12S,15S,23S)-6-(3-carbamimidamidopropyl)-15-[(2S)-2-acetamidohexanamido]-12-[(1H-imidazol-4-yl)methyl]-3-[(1H-indol-3-yl)methyl]-9-[(naphthalen-2-yl)methyl]-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,18-hexaazacyclotricosane-23-carboxamide

库存
6,415 克
纯度
98.7 %
CAS
168482-23-3

化合物标识与属性

CAS
168482-23-3
PubChem CID
134812808
SMILES
CCCC[C@@H](C(=O)NC1CC(=O)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C(NC1=O)CC2=CN=CN2)CC3=CC4=CC=CC=C4C=C3)CCCN=C(N)N)CC5=CNC6=CC=CC=C65)C(=O)N)NC(=O)C
Canonical SMILES
CCCC[C@H](NC(C)=O)C(=O)NC1CC(=O)NCCCC[C@@H](C(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)C(Cc2cnc[nH]2)NC1=O

名称与同义词

  • Shu 9119
  • Shu-9119
  • MBX-36
  • J696.185A
  • 168482-23-3
  • (3S,6S,9R,12S,15S,23S)-2,5,8,11,14,17-Hexaoxo-3-(1H-indol-3-ylmethyl)-6-(3-guanidinopropyl)-9-(2-naphthylmethyl)-12-(1H-imidazol-4-ylmethyl)-15-[[(S)-2-(acetylamino)hexanoyl]amino]-1,4,7,10,13,18-hexaazacyclotricosane-23-carboxamide
  • (3S,6S,9R,12S,15S,23S)-6-(3-carbamimidamidopropyl)-15-[(2S)-2-acetamidohexanamido]-12-[(1H-imidazol-4-yl)methyl]-3-[(1H-indol-3-yl)methyl]-9-[(naphthalen-2-yl)methyl]-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,18-hexaazacyclotricosane-23-carboxamide