[43-Amino-9,35-dihydroxy-5,38-bis(hydroxymethyl)-13,21-dimethyl-7-oxospiro[4,12-dioxa-18,20,42-triazadecacyclo[27.9.6.210,13.02,11.03,8.014,28.016,25.019,24.032,37.039,44]hexatetraconta-2(11),3(8),5,9,16,22,24,32(37),33,35,39,43-dodecaene-30,1'-cyclopentane]-45-yl] 2-[15-(4-cyclopentyl-2-hydroxypentyl)-6,14-dihydroxy-6-pentacyclo[7.7.1.11,5.04,8.013,17]octadeca-2,9(17),10,12-tetraenyl]but-2-enoate

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: [43-Amino-9,35-dihydroxy-5,38-bis(hydroxymethyl)-13,21-dimethyl-7-oxospiro[4,12-dioxa-18,20,42-triazadecacyclo[27.9.6.210,13.02,11.03,8.014,28.016,25.019,24.032,37.039,44]hexatetraconta-2(11),3(8),5,9,16,22,24,32(37),33,35,39,43-dodecaene-30,1'-cyclopentane]-45-yl] 2-[15-(4-cyclopentyl-2-hydroxypentyl)-6,14-dihydroxy-6-pentacyclo[7.7.1.11,5.04,8.013,17]octadeca-2,9(17),10,12-tetraenyl]but-2-enoate
• 英文别名: [43-amino-9,35-dihydroxy-5,38-bis(hydroxymethyl)-13,21-dimethyl-7-oxospiro[4,12-dioxa-18,20,42-triazadecacyclo[27.9.6.210,13.02,11.03,8.014,28.016,25.019,24.032,37.039,44]hexatetraconta-2(11),3(8),5,9,16,22,24,32(37),33,35,39,43-dodecaene-30,1'-cyclopentane]-45-yl] 2-[15-(4-cyclopentyl-2-hydroxypentyl)-6,14-dihydroxy-6-pentacyclo[7.7.1.11,5.04,8.013,17]octadeca-2,9(17),10,12-tetraenyl]but-2-enoate
• 化学式: C₈₁H₉₆N₄O₁₂
• 分子量: 1317.6
• InChiKey: DNBMCOSURYEIDY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.6
• 重原子数：
  97
• 可旋转键数：
  11
• 环数：
  18.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  266
• 氢给体数：
  11
• 氢受体数：
  16