(1S,2S,5S,7R,8R)-7-Hydroxy-8-{2-[(1S,2R,3S,7R,10S,13S,14R)-14-isopropyl-1-methyl-12-azapentacyclo[8.6.0.02,13.03,7.07,12]hexadec-2-yl]ethyl}-1,5-dimethyl-6-oxabicyclo[3.2.1]oct-2-yl acetate

(1S,2S,5S,7R,8R)-7-Hydroxy-8-{2-[(1S,2R,3S,7R,10S,13S,14R)-14-isopropyl-1-methyl-12-azapentacyclo[8.6.0.02,13.03,7.07,12]hexadec-2-yl]ethyl}-1,5-dimethyl-6-oxabicyclo[3.2.1]oct-2-yl acetate 基本信息
CAS号 39729-21-0 分子式 C32H51NO4
分子量 513.75200 精确质量  513.38200
PSA  59.00000 LogP  5.86520

基本信息 展开↓

CAS号:
39729-21-0
3D弹球模型:
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分子式:
C32H51NO4
分子量:
513.75200
英文名称:
(1S,2S,5S,7R,8R)-7-Hydroxy-8-{2-[(1S,2R,3S,7R,10S,13S,14R)-14-isopropyl-1-methyl-12-azapentacyclo[8.6.0.02,13.03,7.07,12]hexadec-2-yl]ethyl}-1,5-dimethyl-6-oxabicyclo[3.2.1]oct-2-yl acetate
英文别名:
(1S,2S,5S,7R,8R)-7-Hydroxy-8-{2-[(1S,2R,3S,7R,10S,13S,14R)-14-isopropyl-1-methyl-12-azapentacyclo[8.6.0.02,13.03,7.07,12]hexadec-2-yl]ethyl}-1,5-dimethyl-6-oxabicyclo[3.2.1]oct-2-yl acetate;
6-Oxabicyclo[3.2.1]octane-2,7-diol,1,5- dimethyl-8-[2-[octahydro-8-methyl-5-(1- methylethyl)-4,8,3a-[1,2,4]butanetriylcyclopent- [b]indol-8a(4aH)-yl]ethyl]-,2-acetate,[3aR- (3aR,4R,4aâ,5â,8R,8aR,8bR,10S*)]-[partial]-
精确分子量/精确质量:
513.38200
极性分子表面积/PSA:
59.00000
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: QCDMEBFUPVLRNE-CDRMYCHRSA-N

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