2-acetyl-4-[(3-butanoyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one

2-acetyl-4-[(3-butanoyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one 基本信息
CAS号 3761-64-6 分子式 C22H26O8
分子量 418.43700 精确质量  418.16300
PSA  152.36000 LogP  3.45920

基本信息 展开↓

CAS号:
3761-64-6
3D弹球模型:
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分子式:
C22H26O8
分子量:
418.43700
英文名称:
2-acetyl-4-[(3-butanoyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one
英文别名:
2-acetyl-4-[(3-butanoyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one;
2,5-Cyclohexadien-1-one,2-acetyl-3,5-dihydroxy-4,4-dimethyl-6-((2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl)methyl);
Acetylflavaspidin-saeure;
Flavaspidsaeure-AB;
Flavaspidinsaeure AB;
Butyrophenone,3'-((5-acetyl-2,4-dihydroxy-3,3-dimethyl-6-oxo-1,4-cyclohexadien-1-yl)methyl)-2',4',6'-trihydroxy-5'-methyl;
UNII-91GX3RYD91;
Flavaspidic acid AB
精确分子量/精确质量:
418.16300
极性分子表面积/PSA:
152.36000
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: XRWVZSPWRNDJNS-UHFFFAOYSA-N

合成路线查看所有的合成路线

  • 50-00-0

    甲醛

  • +

  • 1509-06-4

    1-(2,4,6-trihydroxy-3-methylphenyl)butan-1-one

  • +

  • 16302-39-9

    2-acetyl-3,5-dihydroxy-4,4-dimethyl-2,5-cyclohexadien-1-one

  • 3761-64-6

    2-acetyl-4-[(3-butanoyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one

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  • 50-00-0

    甲醛

  • 1509-06-4

    1-(2,4,6-trihydroxy-3-methylphenyl)butan-1-one

  • 16302-39-9

    2-acetyl-3,5-dihydroxy-4,4-dimethyl-2,5-cyclohexadien-1-one

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