33-Amino-44-cyclopentyloxy-22,43-dihydroxy-6,12-bis(hydroxymethyl)-50-(methoxymethyl)-52-methylspiro[32,34-diazaundecacyclo[33.10.4.319,40.120,24.126,30.137,41.02,16.05,14.07,12.019,39.042,46]pentapentaconta-1(45),5,10,17,20,22,24(55),26(54),27,29,33,38,42(46),43-tetradecaen-47-yne-31,1'-cyclohexane]-4-one

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 33-Amino-44-cyclopentyloxy-22,43-dihydroxy-6,12-bis(hydroxymethyl)-50-(methoxymethyl)-52-methylspiro[32,34-diazaundecacyclo[33.10.4.319,40.120,24.126,30.137,41.02,16.05,14.07,12.019,39.042,46]pentapentaconta-1(45),5,10,17,20,22,24(55),26(54),27,29,33,38,42(46),43-tetradecaen-47-yne-31,1'-cyclohexane]-4-one
• 英文别名: 33-amino-44-cyclopentyloxy-22,43-dihydroxy-6,12-bis(hydroxymethyl)-50-(methoxymethyl)-52-methylspiro[32,34-diazaundecacyclo[33.10.4.319,40.120,24.126,30.137,41.02,16.05,14.07,12.019,39.042,46]pentapentaconta-1(45),5,10,17,20,22,24(55),26(54),27,29,33,38,42(46),43-tetradecaen-47-yne-31,1'-cyclohexane]-4-one
• 化学式: C₆₈H₈₁N₃O₇
• 分子量: 1052.4
• InChiKey: YGKSGWDBDQDCGI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.9
• 重原子数：
  78
• 可旋转键数：
  6
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  167
• 氢给体数：
  6
• 氢受体数：
  8