2-[2-[35-Amino-14-[8-(cyclohexylmethylamino)-11-methyl-7-methylidene-1-oxacyclopentadeca-3,5,10-trien-13-yn-3-yl]-8,15,20,29-tetrahydroxy-4-methyl-3,33-dioxo-31,34-diazaheptacyclo[30.7.1.122,26.05,17.08,16.012,16.036,40]hentetraconta-1(40),4,22(41),23,25,36,38-heptaen-28-yl]-2-(4-hydroxyphenyl)ethyl]guanidine

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 大环内酰胺类
• 英文名称: 2-[2-[35-Amino-14-[8-(cyclohexylmethylamino)-11-methyl-7-methylidene-1-oxacyclopentadeca-3,5,10-trien-13-yn-3-yl]-8,15,20,29-tetrahydroxy-4-methyl-3,33-dioxo-31,34-diazaheptacyclo[30.7.1.122,26.05,17.08,16.012,16.036,40]hentetraconta-1(40),4,22(41),23,25,36,38-heptaen-28-yl]-2-(4-hydroxyphenyl)ethyl]guanidine
• 英文别名: 2-[2-[35-amino-14-[8-(cyclohexylmethylamino)-11-methyl-7-methylidene-1-oxacyclopentadeca-3,5,10-trien-13-yn-3-yl]-8,15,20,29-tetrahydroxy-4-methyl-3,33-dioxo-31,34-diazaheptacyclo[30.7.1.122,26.05,17.08,16.012,16.036,40]hentetraconta-1(40),4,22(41),23,25,36,38-heptaen-28-yl]-2-(4-hydroxyphenyl)ethyl]guanidine
• 化学式: C₇₂H₉₅N₇O₈
• 分子量: 1186.6
• InChiKey: CTCBWXOXBFKKKC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.3
• 重原子数：
  87
• 可旋转键数：
  8
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  271
• 氢给体数：
  11
• 氢受体数：
  12