[(4aR,5S,7R,8S,8aR)-5-acetyloxy-7,8-dimethyl-8-[2-(5-oxo-2H-furan-3-yl)ethyl]spiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-4a-yl]methyl (E)-2-methylbut-2-enoate

[(4aR,5S,7R,8S,8aR)-5-acetyloxy-7,8-dimethyl-8-[2-(5-oxo-2H-furan-3-yl)ethyl]spiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-4a-yl]methyl (E)-2-methylbut-2-enoate 基本信息
CAS号 124961-66-6 分子式 C27H38O7
分子量 474.58600 精确质量  474.26200
PSA  91.43000 LogP  4.29250

基本信息 展开↓

CAS号:
124961-66-6
3D弹球模型:
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分子式:
C27H38O7
分子量:
474.58600
英文名称:
[(4aR,5S,7R,8S,8aR)-5-acetyloxy-7,8-dimethyl-8-[2-(5-oxo-2H-furan-3-yl)ethyl]spiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-4a-yl]methyl (E)-2-methylbut-2-enoate
英文别名:
[(4aR,5S,7R,8S,8aR)-5-acetyloxy-7,8-dimethyl-8-[2-(5-oxo-2H-furan-3-yl)ethyl]spiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-4a-yl]methyl (E)-2-methylbut-2-enoate;
Ajugacumbin A
精确分子量/精确质量:
474.26200
极性分子表面积/PSA:
91.43000
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: TWZAPYCYRPQAOD-PIJHPVSDSA-N

物化性质展开↓

密度:
1.18g/cm3
沸点:
592ºC at 760 mmHg
闪点:
251ºC
折射率:
1.54
蒸汽压:
5.47E-14mmHg at 25°C
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