33-Amino-54-cyclopentyloxy-22,53-dihydroxy-6,12-bis(hydroxymethyl)-61-methylspiro[40-oxa-32,34-diazatetradecacyclo[33.20.4.319,46.120,24.126,30.02,16.05,14.07,12.019,47.036,49.039,44.039,50.046,51.052,56]tetrahexaconta-1(55),5,10,17,20,22,24(64),26(63),27,29,33,37,47,52(56),53-pentadecaen-57-yne-31,1'-cyclohexane]-4-one

• 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: 33-Amino-54-cyclopentyloxy-22,53-dihydroxy-6,12-bis(hydroxymethyl)-61-methylspiro[40-oxa-32,34-diazatetradecacyclo[33.20.4.319,46.120,24.126,30.02,16.05,14.07,12.019,47.036,49.039,44.039,50.046,51.052,56]tetrahexaconta-1(55),5,10,17,20,22,24(64),26(63),27,29,33,37,47,52(56),53-pentadecaen-57-yne-31,1'-cyclohexane]-4-one
• 英文别名: 33-amino-54-cyclopentyloxy-22,53-dihydroxy-6,12-bis(hydroxymethyl)-61-methylspiro[40-oxa-32,34-diazatetradecacyclo[33.20.4.319,46.120,24.126,30.02,16.05,14.07,12.019,47.036,49.039,44.039,50.046,51.052,56]tetrahexaconta-1(55),5,10,17,20,22,24(64),26(63),27,29,33,37,47,52(56),53-pentadecaen-57-yne-31,1'-cyclohexane]-4-one
• 化学式: C₇₄H₈₅N₃O₇
• 分子量: 1128.5
• InChiKey: DXXQVGUNFHOVGP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.7
• 重原子数：
  84
• 可旋转键数：
  4
• 环数：
  16.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  167
• 氢给体数：
  6
• 氢受体数：
  8