(3R,6S,15R,18S,21R,26S,29R,32S,35R,38S)-N-[(2S)-1-[[(2S)-1-amino-5-carbamimidamido-1-oxopentan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-21-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]-15-benzyl-32-[(2S)-butan-2-yl]-6,35-bis(3-carbamimidamidopropyl)-29-(hydroxymethyl)-18-(1H-imidazol-5-ylmethyl)-3-(2-methylsulfanylethyl)-2,5,8,11,14,17,20,28,31,34,37-undecaoxo-23,24-dithia-1,4,7,10,13,16,19,27,30,33,36-undecazabicyclo[36.3.0]hentetracontane-26-carboxamide

• 分子结构分类: 有机化合物 - 有机聚合物 - 多肽
• 英文名称: (3R,6S,15R,18S,21R,26S,29R,32S,35R,38S)-N-[(2S)-1-[[(2S)-1-amino-5-carbamimidamido-1-oxopentan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-21-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]-15-benzyl-32-[(2S)-butan-2-yl]-6,35-bis(3-carbamimidamidopropyl)-29-(hydroxymethyl)-18-(1H-imidazol-5-ylmethyl)-3-(2-methylsulfanylethyl)-2,5,8,11,14,17,20,28,31,34,37-undecaoxo-23,24-dithia-1,4,7,10,13,16,19,27,30,33,36-undecazabicyclo[36.3.0]hentetracontane-26-carboxamide
• 化学式: C₇₆H₁₁₉N₂₇O₁₇S₄
• 分子量: 1811.2
• InChiKey: SFLCUTQJMOWIPJ-GWMSTJMWSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -3.5
• 重原子数：
  124
• 可旋转键数：
  37
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  824
• 氢给体数：
  27
• 氢受体数：
  26