H-DL-Val-Gly-DL-xiIle-DL-Asn-DL-Val-DL-Lys-DL-Cys(1)-DL-Lys-DL-His-DL-Ser-DL-Arg-DL-Gln-DL-Cys(2)-DL-Leu-DL-Lys-DL-Pro-DL-Cys(3)-DL-Lys-DL-Asp-DL-Ala-Gly-DL-Met-DL-Arg-DL-Phe-Gly-DL-Lys-DL-Cys(1)-DL-xiThr-DL-Asn-Gly-DL-Lys-DL-Cys(2)-DL-His-DL-Cys(3)-DL-xiThr-DL-Pro-DL-Lys-OH

• 分子结构分类: 有机化合物 - 有机聚合物 - 多肽
• 英文名称: H-DL-Val-Gly-DL-xiIle-DL-Asn-DL-Val-DL-Lys-DL-Cys(1)-DL-Lys-DL-His-DL-Ser-DL-Arg-DL-Gln-DL-Cys(2)-DL-Leu-DL-Lys-DL-Pro-DL-Cys(3)-DL-Lys-DL-Asp-DL-Ala-Gly-DL-Met-DL-Arg-DL-Phe-Gly-DL-Lys-DL-Cys(1)-DL-xiThr-DL-Asn-Gly-DL-Lys-DL-Cys(2)-DL-His-DL-Cys(3)-DL-xiThr-DL-Pro-DL-Lys-OH
• 英文别名: 6-amino-2-[[1-[2-[[47-[[6-amino-2-[[2-[[4-amino-2-[[2-[[2-[(2-amino-3-methylbutanoyl)amino]acetyl]amino]-3-methylpentanoyl]amino]-4-oxobutanoyl]amino]-3-methylbutanoyl]amino]hexanoyl]amino]-15,39,50,72,89-pentakis(4-aminobutyl)-78-(2-amino-2-oxoethyl)-62-(3-amino-3-oxopropyl)-33-benzyl-30,59-bis(3-carbamimidamidopropyl)-18-(carboxymethyl)-81-(1-hydroxyethyl)-56-(hydroxymethyl)-4,53-bis(1H-imidazol-4-ylmethyl)-21-methyl-86-(2-methylpropyl)-27-(2-methylsulfanylethyl)-2,5,13,16,19,22,25,28,31,34,37,40,48,51,54,57,60,63,71,74,77,80,83,84,87,90,96-heptacosaoxo-9,10,44,45,67,68-hexathia-3,6,14,17,20,23,26,29,32,35,38,41,49,52,55,58,61,64,70,73,76,79,82,85,88,91,97-heptacosazatetracyclo[40.27.14.1412,65.091,95]heptanonacontane-7-carbonyl]amino]-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]amino]hexanoic acid
• 化学式: C₁₆₉H₂₈₁N₅₇O₄₆S₇
• 分子量: 4072.0
• InChiKey: KOXLLJFKLFSCAF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -19.4
• 重原子数：
  279
• 可旋转键数：
  83
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  1860
• 氢给体数：
  58
• 氢受体数：
  65