2,2,2-trichloroethyl (6S,6aR,7R,13S,14R,16R)-8-(allyloxy)-14-cyano-5,6-dihydroxy-16-(hydroxymethyl)-9-methoxy-4,10-dimethyl-6,6a,7,13,14,16-hexahydro-12H-7,13-epiminobenzo[4,5]azocino[1,2-b][1,3]dioxolo[4,5-h]isoquinoline-17-carboxylate

2,2,2-trichloroethyl (6S,6aR,7R,13S,14R,16R)-8-(allyloxy)-14-cyano-5,6-dihydroxy-16-(hydroxymethyl)-9-methoxy-4,10-dimethyl-6,6a,7,13,14,16-hexahydro-12H-7,13-epiminobenzo[4,5]azocino[1,2-b][1,3]dioxolo[4,5-h]isoquinoline-17-carboxylate 基本信息
CAS号 442663-60-7 分子式 C31H32Cl3N3O9
分子量 696.95900 精确质量  695.12000
PSA  154.18000 LogP  4.31848

基本信息 展开↓

CAS号:
442663-60-7
3D弹球模型:
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分子式:
C31H32Cl3N3O9
分子量:
696.95900
英文名称:
2,2,2-trichloroethyl (6S,6aR,7R,13S,14R,16R)-8-(allyloxy)-14-cyano-5,6-dihydroxy-16-(hydroxymethyl)-9-methoxy-4,10-dimethyl-6,6a,7,13,14,16-hexahydro-12H-7,13-epiminobenzo[4,5]azocino[1,2-b][1,3]dioxolo[4,5-h]isoquinoline-17-carboxylate
英文别名:
2,2,2-trichloroethyl (6S,6aR,7R,13S,14R,16R)-8-(allyloxy)-14-cyano-5,6-dihydroxy-16-(hydroxymethyl)-9-methoxy-4,10-dimethyl-6,6a,7,13,14,16-hexahydro-12H-7,13-epiminobenzo[4,5]azocino[1,2-b][1,3]dioxolo[4,5-h]isoquinoline-17-carboxylate
精确分子量/精确质量:
695.12000
极性分子表面积/PSA:
154.18000
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: RPPKTCYISDEVLN-NDLWRCNMSA-N

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