(3β)-3-{[2-O-(β-D-吡喃葡萄糖基)-β-D-赤藓-五吡喃糖基-3-酮糖]氧代}齐墩果-12-烯-28-酸

(3β)-3-{[2-O-(β-D-吡喃葡萄糖基)-β-D-赤藓-五吡喃糖基-3-酮糖]氧代}齐墩果-12-烯-28-酸 基本信息
CAS号 117585-05-4 分子式 C41H64O12
分子量 748.94000 精确质量  748.44000
PSA  192.44000 LogP  3.72930

基本信息 展开↓

CAS号:
117585-05-4
3D弹球模型:
立即前往扯扯看
分子式:
C41H64O12
分子量:
748.94000
中文名称:
(3β)-3-{[2-O-(β-D-吡喃葡萄糖基)-β-D-赤藓-五吡喃糖基-3-酮糖]氧代}齐墩果-12-烯-28-酸
英文名称:
(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2S,3S,5R)-5-hydroxy-4-oxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
中文别名:
(3β)-3-{[2-O-(β-D-吡喃葡萄糖基)-β-D-赤藓-五吡喃糖基-3-酮糖]氧代}齐墩果-12-烯-28-酸;
(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2S,3S,5R)-5-hydroxy-4-oxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
英文别名:
(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2S,3S,5R)-5-hydroxy-4-oxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
精确分子量/精确质量:
748.44000
极性分子表面积/PSA:
192.44000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
The Key: GXWUEMSASMVWKO-LFGJQLCQSA-N

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