3-[10,15-Dibromo-7,12,17-tris(2-carboxyethyl)-8,18-bis(carboxymethyl)-3,13-dimethyl-21,22,23,24-tetrahydroporphyrin-2-yl]propanoic acid;methyl 3-[5,20-dibromo-8,13-bis(2-methoxy-2-oxoethyl)-7,12,17-tris(3-methoxy-3-oxopropyl)-3-methyl-18-(2-oxopropyl)-21,22,23,24-tetrahydroporphyrin-2-yl]propanoate;methyl 3-[10,15-dibromo-18-(2-methoxy-2-oxoethyl)-7,12,17-tris(3-methoxy-3-oxopropyl)-3,13-dimethyl-8-(2-oxopropyl)-21,22,23,24-tetrahydroporphyrin-2-yl]propanoate

• 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: 3-[10,15-Dibromo-7,12,17-tris(2-carboxyethyl)-8,18-bis(carboxymethyl)-3,13-dimethyl-21,22,23,24-tetrahydroporphyrin-2-yl]propanoic acid;methyl 3-[5,20-dibromo-8,13-bis(2-methoxy-2-oxoethyl)-7,12,17-tris(3-methoxy-3-oxopropyl)-3-methyl-18-(2-oxopropyl)-21,22,23,24-tetrahydroporphyrin-2-yl]propanoate;methyl 3-[10,15-dibromo-18-(2-methoxy-2-oxoethyl)-7,12,17-tris(3-methoxy-3-oxopropyl)-3,13-dimethyl-8-(2-oxopropyl)-21,22,23,24-tetrahydroporphyrin-2-yl]propanoate
• 英文别名: 3-[10,15-dibromo-7,12,17-tris(2-carboxyethyl)-8,18-bis(carboxymethyl)-3,13-dimethyl-21,22,23,24-tetrahydroporphyrin-2-yl]propanoic acid;methyl 3-[5,20-dibromo-8,13-bis(2-methoxy-2-oxoethyl)-7,12,17-tris(3-methoxy-3-oxopropyl)-3-methyl-18-(2-oxopropyl)-21,22,23,24-tetrahydroporphyrin-2-yl]propanoate;methyl 3-[10,15-dibromo-18-(2-methoxy-2-oxoethyl)-7,12,17-tris(3-methoxy-3-oxopropyl)-3,13-dimethyl-8-(2-oxopropyl)-21,22,23,24-tetrahydroporphyrin-2-yl]propanoate
• 化学式: C128H140Br6N12O36
• 分子量: 2902.0
• InChiKey: LATZFJRVOUNAGP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.34
• 重原子数：
  182
• 可旋转键数：
  61
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  714
• 氢给体数：
  18
• 氢受体数：
  42