[5-acetamido-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methyl acetate

[5-acetamido-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methyl acetate 基本信息
CAS号 63064-64-2 分子式 C18H23N5O7
分子量 421.40500 精确质量  421.16000
PSA  135.68000 LogP  -0.67990

等价的CAS号:

63064-64-2,70675-25-1,70800-68-9

基本信息 展开↓

CAS号:
63064-64-2
3D弹球模型:
立即前往扯扯看
分子式:
C18H23N5O7
分子量:
421.40500
英文名称:
[5-acetamido-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methyl acetate
英文别名:
[5-acetamido-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methyl acetate;
7-(2-acetoxymethyl-5-acetylamino-6-methoxy-3,6-dihydro-2H-pyran-3-yl)-1,3-dimethyl-3,7-dihydro-purine-2,6-dione;
7-(|A-Cellobiosyloxy)-4-methyl-coumarin Heptaacetate;
4-Methylumbelliferyl Di-N-Acetyl-|A-D-chitobiose Peracetate
精确分子量/精确质量:
421.16000
极性分子表面积/PSA:
135.68000
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: AAMHLDYPMSIFIW-AHIWAGSCSA-N

物化性质展开↓

密度:
1.49g/cm3
折射率:
1.645

合成路线查看所有的合成路线

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    7-(2-acetamido-4,6-di-O-acetyl-2,3-dideoxy-D-threo-hex-2-enopyranosyl)theophylline

  • ~46%

  • 63064-64-2

    [5-acetamido-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methyl acetate

  • +

  • 70675-25-1

    7-(methyl 2-acetamido-6-O-acetyl-2,3,4-trideoxy-β-D-erythro-hex-2-enopyranosid-4-yl)theophylline

  • 67-56-1

    甲醇

  • +

  • 58-55-9

    茶碱

  • +

  • 10293-60-4

    10293-60-4

  • ~2%

  • 63064-64-2

    [5-acetamido-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methyl acetate

  • +

  • 70800-68-9

    [5-acetamido-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methyl acetate

  • +

  • 80035-41-2

    7-(2-acetamido-4,6-di-O-acetyl-2,3-dideoxy-D-threo-hex-2-enopyranosyl)theophilline

  • +

  • 80035-38-7

    7-(2-acetamido-4,6-di-O-acetyl-2,3-dideoxy-D-threo-hex-2-enopyranosyl)theophylline

  • 67-56-1

    甲醇

  • +

  • 58-55-9

    茶碱

  • +

  • 10293-60-4

    10293-60-4

  • ~2%

  • 63064-64-2

    [5-acetamido-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methyl acetate

  • +

  • 70800-68-9

    [5-acetamido-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methyl acetate

  • +

  • 70675-25-1

    7-(methyl 2-acetamido-6-O-acetyl-2,3,4-trideoxy-β-D-erythro-hex-2-enopyranosid-4-yl)theophylline

  • +

  • 80035-38-7

    7-(2-acetamido-4,6-di-O-acetyl-2,3-dideoxy-D-threo-hex-2-enopyranosyl)theophylline

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  • 80035-38-7

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  • 67-56-1

    甲醇

  • 58-55-9

    茶碱

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