(3R,6R,8R,9R,10S,11S,12R)-11-[(2,6-dideoxy-3-C-methyl-3-O-methyl-α-L-ribo-hexopyranosyl)oxy]-2-[(1R,2R)-1,2-dihydroxy-1-methylbutyl]-8-hydroxy-3,4,6,8,10,12-hexamethyl-9-[(3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl)oxy]-1-oxa-4-azacyclotridecan-13-one | 783333-62-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (3R,6R,8R,9R,10S,11S,12R)-11-[(2,6-dideoxy-3-C-methyl-3-O-methyl-α-L-ribo-hexopyranosyl)oxy]-2-[(1R,2R)-1,2-dihydroxy-1-methylbutyl]-8-hydroxy-3,4,6,8,10,12-hexamethyl-9-[(3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl)oxy]-1-oxa-4-azacyclotridecan-13-one
• 英文别名: (3R,6R,8R,9R,10S,11S,12R)-2-[(2R,3R)-2,3-dihydroxypentan-2-yl]-9-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-8-hydroxy-11-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,4,6,8,10,12-hexamethyl-1-oxa-4-azacyclotridecan-13-one
• CAS: 783333-62-0
• 化学式: C₃₈H₇₂N₂O₁₂
• 分子量: 748.996
• InChiKey: CTUJTLZDRKSFHF-DQSGGHHJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  52
• 可旋转键数：
  9
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.97
• 拓扑面积：
  180
• 氢给体数：
  5
• 氢受体数：
  14