2-[35-Amino-46-ethyl-6,16,21,40-tetrahydroxy-26-(hydroxymethyl)-11-methoxy-7-(2-methylpropyl)spiro[23,48-dioxa-34,36-diazanonacyclo[40.2.2.12,10.113,17.118,22.04,9.024,29.025,32.014,49]nonatetraconta-4,6,8,10,12,14(49),18(47),19,21,30,35,43-dodecaene-38,2'-cyclopentane]-1'-yl]acetaldehyde

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 萘并吡喃类
• 英文名称: 2-[35-Amino-46-ethyl-6,16,21,40-tetrahydroxy-26-(hydroxymethyl)-11-methoxy-7-(2-methylpropyl)spiro[23,48-dioxa-34,36-diazanonacyclo[40.2.2.12,10.113,17.118,22.04,9.024,29.025,32.014,49]nonatetraconta-4,6,8,10,12,14(49),18(47),19,21,30,35,43-dodecaene-38,2'-cyclopentane]-1'-yl]acetaldehyde
• 英文别名: 2-[35-amino-46-ethyl-6,16,21,40-tetrahydroxy-26-(hydroxymethyl)-11-methoxy-7-(2-methylpropyl)spiro[23,48-dioxa-34,36-diazanonacyclo[40.2.2.12,10.113,17.118,22.04,9.024,29.025,32.014,49]nonatetraconta-4,6,8,10,12,14(49),18(47),19,21,30,35,43-dodecaene-38,2'-cyclopentane]-1'-yl]acetaldehyde
• 化学式: C₅₉H₇₇N₃O₉
• 分子量: 972.3
• InChiKey: JWFVNSOFLUWOCE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.7
• 重原子数：
  71
• 可旋转键数：
  7
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  196
• 氢给体数：
  7
• 氢受体数：
  10