(1R,3aR,4R,7aR)-1-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-4-[(1R,2Z)-1-hydroxy-2-[(5S)-5-hydroxy-2-methylidenecyclohexylidene]ethyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ol

(1R,3aR,4R,7aR)-1-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-4-[(1R,2Z)-1-hydroxy-2-[(5S)-5-hydroxy-2-methylidenecyclohexylidene]ethyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ol 基本信息
CAS号 84985-78-4 分子式 C28H46O3
分子量 430.66300 精确质量  430.34500
PSA  60.69000 LogP  5.80660

基本信息 展开↓

CAS号:
84985-78-4
3D弹球模型:
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分子式:
C28H46O3
分子量:
430.66300
英文名称:
(1R,3aR,4R,7aR)-1-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-4-[(1R,2Z)-1-hydroxy-2-[(5S)-5-hydroxy-2-methylidenecyclohexylidene]ethyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ol
英文别名:
(1R,3aR,4R,7aR)-1-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-4-[(1R,2Z)-1-hydroxy-2-[(5S)-5-hydroxy-2-methylidenecyclohexylidene]ethyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ol;
(1R,3aR,4R,7aR)-Octahydro-4-hydroxy-|A-[(Z)-[(5S)-5-hydroxy-2-methylenecyclohexylidene]methyl]-7a-methyl-1-[(1R,2E,4R)-1,4,5-trimethyl-2-hexen-1-yl]-1H-indene-4-methanol;
4,5-Dihydroxy Vitamin D2;
7,8-dihydroxy-7,8-dihydrovitamin D2;
(5Z,7E)-(3R)-3,7,8-trihydroxy-9,10-seco-5,7,10(19)-ergostatrien;
(3|A,5Z,7R,8|A,22E)-9,10-Secoergosta-5,10(19),22-triene-3,7,8-triol
精确分子量/精确质量:
430.34500
极性分子表面积/PSA:
60.69000
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: KXILCRGOVVVVRF-LXIOOFRVSA-N

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