Methyl (12S,13S,14E)-14-ethylidene-12-(hydroxymethyl)-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraene-12-carboxylate 1-oxide

Methyl (12S,13S,14E)-14-ethylidene-12-(hydroxymethyl)-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraene-12-carboxylate 1-oxide 基本信息
CAS号 126594-73-8 分子式 C20H24N2O4
分子量 356.41600 精确质量  356.17400
PSA  91.75000 LogP  2.32420

基本信息 展开↓

CAS号:
126594-73-8
3D弹球模型:
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分子式:
C20H24N2O4
分子量:
356.41600
中文名称:
Methyl (12S,13S,14E)-14-ethylidene-12-(hydroxymethyl)-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraene-12-carboxylate 1-oxide
英文名称:
Methyl (12S,13S,14E)-14-ethylidene-12-(hydroxymethyl)-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraene-12-carboxylate 1-oxide
中文别名:
Methyl (12S,13S,14E)-14-ethylidene-12-(hydroxymethyl)-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraene-12-carboxylate 1-oxide
英文别名:
Methyl (12S,13S,14E)-14-ethylidene-12-(hydroxymethyl)-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraene-12-carboxylate 1-oxide;
validamycin H;
vallesamine Nb-oxide;
validamycin B;
validamycin D
精确分子量/精确质量:
356.17400
极性分子表面积/PSA:
91.75000
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: CWLUMLLPZBYHMO-QJWCMHSQSA-N

合成路线查看所有的合成路线

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    4-Ethylidene-1,3,4,5,6,7-hexahydro-6-(hydroxymethyl)-2,5-ethano-2H-azocino[4,3-b]indole-6-carboxylic acid methyl ester

  • 126594-73-8

    Methyl (12S,13S,14E)-14-ethylidene-12-(hydroxymethyl)-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraene-12-carboxylate 1-oxide

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  • 56324-22-2

    4-Ethylidene-1,3,4,5,6,7-hexahydro-6-(hydroxymethyl)-2,5-ethano-2H-azocino[4,3-b]indole-6-carboxylic acid methyl ester

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