2-[[3-[4-[[4-[[2-[[2-[[1,7-Bis[4-[2-[bis(carboxymethyl)amino]-3-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]propyl]anilino]-4-[3-[4-[2-[bis(carboxymethyl)amino]-3-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]propyl]anilino]-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-2-oxoethyl]-[3-[11-ethyl-16-[1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-12,17,21,26-tetramethyl-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(22),7,9,11,13(25),14,16,18,20-nonaen-22-yl]propanoyl]amino]acetyl]amino]-7-[4-[2-[bis(carboxymethyl)amino]-3-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]propyl]anilino]-4-[3-[4-[2-[bis(carboxymethyl)amino]-3-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]propyl]anilino]-3-oxopropyl]-7-oxoheptanoyl]amino]phenyl]-2-[bis(carboxymethyl)amino]propyl]-[2-[bis(carboxymethyl)amino]ethyl]amino]acetic acid

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 四吡咯及其衍生物
• 英文名称: 2-[[3-[4-[[4-[[2-[[2-[[1,7-Bis[4-[2-[bis(carboxymethyl)amino]-3-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]propyl]anilino]-4-[3-[4-[2-[bis(carboxymethyl)amino]-3-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]propyl]anilino]-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-2-oxoethyl]-[3-[11-ethyl-16-[1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-12,17,21,26-tetramethyl-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(22),7,9,11,13(25),14,16,18,20-nonaen-22-yl]propanoyl]amino]acetyl]amino]-7-[4-[2-[bis(carboxymethyl)amino]-3-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]propyl]anilino]-4-[3-[4-[2-[bis(carboxymethyl)amino]-3-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]propyl]anilino]-3-oxopropyl]-7-oxoheptanoyl]amino]phenyl]-2-[bis(carboxymethyl)amino]propyl]-[2-[bis(carboxymethyl)amino]ethyl]amino]acetic acid
• 英文别名: 2-[[3-[4-[[4-[[2-[[2-[[1,7-bis[4-[2-[bis(carboxymethyl)amino]-3-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]propyl]anilino]-4-[3-[4-[2-[bis(carboxymethyl)amino]-3-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]propyl]anilino]-3-oxopropyl]-1,7-dioxoheptan-4-yl]amino]-2-oxoethyl]-[3-[11-ethyl-16-[1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-12,17,21,26-tetramethyl-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(22),7,9,11,13(25),14,16,18,20-nonaen-22-yl]propanoyl]amino]acetyl]amino]-7-[4-[2-[bis(carboxymethyl)amino]-3-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]propyl]anilino]-4-[3-[4-[2-[bis(carboxymethyl)amino]-3-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]propyl]anilino]-3-oxopropyl]-7-oxoheptanoyl]amino]phenyl]-2-[bis(carboxymethyl)amino]propyl]-[2-[bis(carboxymethyl)amino]ethyl]amino]acetic acid
• 化学式: C₁₉₀H₂₅₇N₃₁O₇₃
• 分子量: 4143.0
• InChiKey: DGCKMUFNNCENFK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -42.5
• 重原子数：
  294
• 可旋转键数：
  153
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.52
• 拓扑面积：
  1520
• 氢给体数：
  40
• 氢受体数：
  94