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    首页 分子通 [(2R,3S,5S)-5-(6-amino-7H-purin-9-ium-9-yl)-2-[[[9-[(2R,3R,4S,5R)-4-[[(2R,5R)-4-[[2-[2-[[2-[[(2R,5R)-5-[[[(2R,3S,4R,5R)-5-[6-[[(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-4-[[2-[[2-[(2-sulfanylacetyl)amino]acetyl]amino]acetyl]amino]oxolan-2-yl]oxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxyamino]purin-9-yl]-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-2-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-3-yl]amino]-2-oxoethyl]-methylamino]ethyl-methylamino]acetyl]amino]-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]oxymethyl]oxolan-3-yl] [(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-4-[[2-[[2-[(2-sulfanylacetyl)amino]acetyl]amino]acetyl]amino]oxolan-2-yl] hydrogen phosphate

    [(2R,3S,5S)-5-(6-amino-7H-purin-9-ium-9-yl)-2-[[[9-[(2R,3R,4S,5R)-4-[[(2R,5R)-4-[[2-[2-[[2-[[(2R,5R)-5-[[[(2R,3S,4R,5R)-5-[6-[[(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-4-[[2-[[2-[(2-sulfanylacetyl)amino]acetyl]amino]acetyl]amino]oxolan-2-yl]oxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxyamino]purin-9-yl]-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-2-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-3-yl]amino]-2-oxoethyl]-methylamino]ethyl-methylamino]acetyl]amino]-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]oxymethyl]oxolan-3-yl] [(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-4-[[2-[[2-[(2-sulfanylacetyl)amino]acetyl]amino]acetyl]amino]oxolan-2-yl] hydrogen phosphate

    分子结构分类

    有机化合物 - 核苷、核苷酸和类似物 - （3'->5'）-二核苷酸和类似物
    中文名称
    ——
    中文别名
    ——
    英文名称
    [(2R,3S,5S)-5-(6-amino-7H-purin-9-ium-9-yl)-2-[[[9-[(2R,3R,4S,5R)-4-[[(2R,5R)-4-[[2-[2-[[2-[[(2R,5R)-5-[[[(2R,3S,4R,5R)-5-[6-[[(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-4-[[2-[[2-[(2-sulfanylacetyl)amino]acetyl]amino]acetyl]amino]oxolan-2-yl]oxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxyamino]purin-9-yl]-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-2-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-3-yl]amino]-2-oxoethyl]-methylamino]ethyl-methylamino]acetyl]amino]-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]oxymethyl]oxolan-3-yl] [(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-4-[[2-[[2-[(2-sulfanylacetyl)amino]acetyl]amino]acetyl]amino]oxolan-2-yl] hydrogen phosphate
    英文别名
    ——
    [(2R,3S,5S)-5-(6-amino-7H-purin-9-ium-9-yl)-2-[[[9-[(2R,3R,4S,5R)-4-[[(2R,5R)-4-[[2-[2-[[2-[[(2R,5R)-5-[[[(2R,3S,4R,5R)-5-[6-[[(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-4-[[2-[[2-[(2-sulfanylacetyl)amino]acetyl]amino]acetyl]amino]oxolan-2-yl]oxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxyamino]purin-9-yl]-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-2-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-3-yl]amino]-2-oxoethyl]-methylamino]ethyl-methylamino]acetyl]amino]-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]oxymethyl]oxolan-3-yl] [(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-4-[[2-[[2-[(2-sulfanylacetyl)amino]acetyl]amino]acetyl]amino]oxolan-2-yl] hydrogen phosphate化学式
    CAS
    ——
    化学式
    C94H121N38O50P4S2+
    mdl
    ——
    分子量
    2771.2
    InChiKey
    CGQABQYHHGTVMC-CFQMRLJZSA-O
    BEILSTEIN
    ——
    EINECS
    ——
    • 物化性质
    • 计算性质
    • ADMET
    • 安全信息
    • SDS
    • 制备方法与用途
    • 上下游信息
    • 反应信息
    • 文献信息
    • 表征谱图
    • 同类化合物
    • 相关功能分类
    • 相关结构分类

    计算性质

    • 辛醇/水分配系数(LogP)：
      -23.6
    • 重原子数：
      188
    • 可旋转键数：
      57
    • 环数：
      20.0
    • sp3杂化的碳原子比例：
      0.53
    • 拓扑面积：
      1170
    • 氢给体数：
      31
    • 氢受体数：
      69

    同类化合物

    鸟苷酰-(3'-5')-尿苷 鸟苷酰(3'-5')尿苷3'-单磷酸酯 腺苷酰基-(3,’5’)-胞苷 腺苷酰-(3'→5')-胞苷 腺苷酰-(3'-5')-尿苷3'-单磷酸酯 腺苷基3'-5'-腺苷铵盐 脱氧鸟苷酰-(3'-5')-脱氧腺苷 脱氧腺苷酰-(3'-5')-脱氧鸟苷 脱氧胞苷酰-(3'-5')-脱氧鸟苷 胸苷酰(3'->5')胸苷铵盐 胸苷基（3'5'）-2'-脱氧腺苷铵盐 胞苷酰-(5'->3')-鸟苷 胞苷酰-(3',5')-鸟苷 胞苷酰(3'->5')尿苷铵盐 聚(2-氨基脱氧腺嘌呤基-5-碘脱氧尿苷酸) 聚(2-氨基脱氧腺嘌呤基-5-溴脱氧尿苷酸) 环二腺苷酸 尿酸氧化酶 尿苷酰基-(3',5')-尿苷 二(3',5')-环二鸟苷酸 乙基3,4,5-三[[(6-重氮基-5,6-二氢-5-羰基-1-萘基)磺基基]氧代]苯酸酯 [5-(6-氨基嘌呤-9-基)-4-羟基-2-(羟基甲基)四氢呋喃-3-基][5-(2,4-二氧代嘧啶-1-基)-3,4-二羟基四氢呋喃-2-基]甲基磷酸氢酯 [5-(6-氨基嘌呤-9-基)-3,4-二羟基-四氢呋喃-2-基]甲基[羟基-[2,3,4-三羟基-5-(7-甲基-2,4,8-三氧代-1H-嘧啶并[4,5-b]喹啉-10-基)戊氧基]磷酰]磷酸氢酯 [5-(4-氨基-2-氧代-嘧啶-1-基)-3,4-二羟基-四氢呋喃-2-基]甲基[5-(4-氨基-2-氧代-嘧啶-1-基)-4-羟基-2-(羟基甲基)四氢呋喃-3-基]磷酸氢酯 [5-(2-氨基-6-氧代-3H-嘌呤-9-基)-3,4-二羟基四氢呋喃-2-基]甲基[5-(6-氨基嘌呤-9-基)-4-羟基-2-(羟基甲基)四氢呋喃-3-基]磷酸氢酯 [(2R,3S,5R)-5-(6-氨基嘌呤-9-基)-2-(膦酰氧基甲基)四氢呋喃-3-基][(2R,3S,5R)-5-(2,4-二氧代嘧啶-1-基)-3-羟基四氢呋喃-2-基]甲基磷酸氢酯 [(2R,3S,5R)-5-(4-氨基-2-氧代嘧啶-1-基)-3-羟基四氢呋喃-2-基]甲基 [(2R,3S,5R)-2-(羟基甲基)-5-(5-甲基-2,4-二氧代嘧啶-1-基)四氢呋喃-3-基]磷酸氢酯 [(2R,3S,5R)-5-(4-氨基-2-氧代嘧啶-1-基)-2-(膦酰氧基甲基)四氢呋喃-3-基][(2R,3S,4R,5R)-5-(6-氨基嘌呤-9-基)-3,4-二羟基四氢呋喃-2-基]甲基磷酸氢酯 [(2R,3S,4R,5R)-5-(6-氨基嘌呤-9-基)-3,4-二羟基四氢呋喃-2-基]甲基[(2R,3S,4R,5R)-5-(2,4-二氧代嘧啶-1-基)-4-羟基-2-(羟基甲基)四氢呋喃-3-基]磷酸氢酯 [(2R,3S,4R,5R)-5-(2-氨基-6-氧代-3H-嘌呤-9-基)-3,4-二羟基四氢呋喃-2-基]甲基[(2R,3S,4R,5R)-5-(2-氨基-6-氧代-3H-嘌呤-9-基)-4-羟基-2-(羟基甲基)四氢呋喃-3-基]磷酸氢酯 8-氯-黄素腺嘌呤二核苷酸 8-巯基-黄素腺嘌呤二核苷酸 5'-O-胸苷酰 3'-O-(2'-脱氧腺苷)硫代磷酸酯 2'-脱氧鸟苷酰-(5'-3')-2'-脱氧-5'-鸟苷酸 2'-脱氧鸟苷酰-(3'-5')-2'-脱氧胞苷 2'-脱氧腺苷酰-(3'-5')-2'-脱氧腺苷 2'-脱氧胞啶基(3'->5')-2'-脱氧鸟苷铵盐 1-(2-脱氧-5-O-磷羧基五呋喃糖基)-5-[(1E)-3-{[5-(2-羰基六氢-1H-噻吩并[3,4-d]咪唑-4-基)戊酰基]氨基}丙-1-烯-1-基]嘧啶-2,4(1H,3H)-二酮 5'-dCT 2'-deoxyadenylyl-(3',5')-thymidine ammonium salt d(GpT) [(2R,3R,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-2-(hydroxymethyl)-4-methoxyoxolan-3-yl] [(2R,3R,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-4-prop-2-ynoxyoxolan-2-yl]methyl hydrogen phosphate pA3'p5'U pG3'p5'U pG3'p5'C cytidylyl-(3'-5')-3'-amino-3'-deoxy-3'-L-phenylalanyl-N6,N6-dimethyladenosine adenylyl-(3',5')-guanosine deoxyadenosyl(5'-3')thymidine phosphate cAIMP N4-palmitoyl-2'-deoxycytidylyl-(3'->5')-5-fluoro-2'-deoxyuridine

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