27-[2-[4-Hydroxy-3-[(3-hydroxyphenyl)methyl]phenyl]ethyl]-15-(hydroxymethyl)-34-methoxy-7-spiro[6-oxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),2,11(15),12-tetraene-7,1'-cyclohexane]-16-yl-11,40-dioxa-2,35,37-triazaoctacyclo[21.14.3.12,5.116,20.04,9.012,17.030,38.031,36]dotetraconta-1(38),3,5(42),6,8,12,14,16,18,30-decaen-28-yne-13,21-diol

• 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: 27-[2-[4-Hydroxy-3-[(3-hydroxyphenyl)methyl]phenyl]ethyl]-15-(hydroxymethyl)-34-methoxy-7-spiro[6-oxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),2,11(15),12-tetraene-7,1'-cyclohexane]-16-yl-11,40-dioxa-2,35,37-triazaoctacyclo[21.14.3.12,5.116,20.04,9.012,17.030,38.031,36]dotetraconta-1(38),3,5(42),6,8,12,14,16,18,30-decaen-28-yne-13,21-diol
• 英文别名: 27-[2-[4-hydroxy-3-[(3-hydroxyphenyl)methyl]phenyl]ethyl]-15-(hydroxymethyl)-34-methoxy-7-spiro[6-oxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),2,11(15),12-tetraene-7,1'-cyclohexane]-16-yl-11,40-dioxa-2,35,37-triazaoctacyclo[21.14.3.12,5.116,20.04,9.012,17.030,38.031,36]dotetraconta-1(38),3,5(42),6,8,12,14,16,18,30-decaen-28-yne-13,21-diol
• 化学式: C₇₄H₇₉N₃O₉
• 分子量: 1154.4
• InChiKey: GHFCPQKQDKMAEI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.5
• 重原子数：
  86
• 可旋转键数：
  8
• 环数：
  16.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  167
• 氢给体数：
  7
• 氢受体数：
  11