4α-acetoxy-2α-benzoyIoxy-5β,20-epoxy-1β,13α-dihydroxy-10β-methoxy-9-oxo-7β-triethylsilyloxy-11-taxene | 160084-70-8
中文名称
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中文别名
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英文名称
4α-acetoxy-2α-benzoyIoxy-5β,20-epoxy-1β,13α-dihydroxy-10β-methoxy-9-oxo-7β-triethylsilyloxy-11-taxene
英文别名
4α-acetoxy-2α-benzoyloxy-5β,20-epoxy-1β,13α-dihydroxy-10β-methoxy-9-oxo-7β-triethylsilyloxy-11-taxene；10β-methoxy-10-deacetoxy-7-O-triethylsilyl baccatin-III；10-deacetyl-10-methyl-7-triethylsilyl baccatin III；10-methyl-7-triethylsilylbaccatin III；10-O-methyl-7-O-triethylsilyl-10-DAB；[(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4-acetyloxy-1,15-dihydroxy-12-methoxy-10,14,17,17-tetramethyl-11-oxo-9-triethylsilyloxy-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
CAS
160084-70-8
化学式
C36H52O10Si
mdl
——
分子量
672.888
InChiKey
KLLWBNOFRRRKCG-HCMCJCFHSA-N
BEILSTEIN
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EINECS
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物化性质
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计算性质
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ADMET
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安全信息
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SDS
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制备方法与用途
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上下游信息
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文献信息
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表征谱图
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同类化合物
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相关功能分类
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相关结构分类
物化性质
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沸点：704.7±60.0 °C(Predicted)
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密度：1.22±0.1 g/cm3(Predicted)
计算性质
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辛醇/水分配系数(LogP)：4.77
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重原子数：47
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可旋转键数：11
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环数：5.0
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sp3杂化的碳原子比例：0.69
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拓扑面积：138
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氢给体数：2
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氢受体数：10
上下游信息
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上游原料
中文名称 英文名称 CAS号 化学式 分子量 7-O-(三乙基硅烷基)-10-去乙酰基浆果赤霉素III 7-triethylsilyl-10-deacetylbaccatin III 115437-18-8 C35H50O10Si 658.861 10-脱乙酰基巴卡丁 III 10-deacetylbaccatin III 32981-86-5 C29H36O10 544.599 -
下游产品
中文名称 英文名称 CAS号 化学式 分子量 —— [(1S,2S,3R,4S,7R,9S,10S,12R)-4-acetyloxy-1-hydroxy-12-methoxy-10,14,17,17-tetramethyl-11,15-dioxo-9-triethylsilyloxy-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate 1531632-38-8 C36H50O10Si 670.872 —— [(1R,2S,3R,4S,7R,9S,10S,12R,16R)-4-acetyloxy-1,16-dihydroxy-12-methoxy-10,14,17,17-tetramethyl-11,15-dioxo-9-triethylsilyloxy-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate 1531632-45-7 C36H50O11Si 686.872 —— 4α-acetoxy-2α-benzoyloxy-5β,20-epoxy-10β-methoxy-9-oxo-1β,13α,7β-trihydroxy-11-taxene 183133-97-3 C30H38O10 558.626 —— 10-methoxyl-7-triethylsilicane-1,14-carbonate baccatin III 1531632-21-9 C37H50O12Si 714.882 7β,10β-二甲氧基多西紫杉醇 4α-acetoxy-2α-benzoyloxy-5β,20-epoxy-1β,13α-dihydroxy-7β,10β-dimethoxy-9-oxo-11-taxene 183133-94-0 C31H40O10 572.653 —— 7-methoxyformyl-10-methoxy baccatin III 1531632-18-4 C32H40O12 616.662 —— 10-methyl-7-dimethylaminocarbonylbaccatin III 1531632-17-3 C33H43NO11 629.705 —— [(1S,2S,3R,4S,7R,9S,10S,12R,16R)-4-acetyloxy-12-methoxy-10,14,20,20-tetramethyl-11,15,18-trioxo-9-triethylsilyloxy-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-2-yl] benzoate 1531632-52-6 C37H48O12Si 712.866 —— [(1S,2S,3R,4S,7R,10R,12R)-4-acetyloxy-1-hydroxy-12-methoxy-10,14,17,17-tetramethyl-11,15-dioxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate 1531632-37-7 C30H36O9 540.61 —— [(1R,2S,3R,4S,7R,10R,12R,16R)-4-acetyloxy-1,16-dihydroxy-12-methoxy-10,14,17,17-tetramethyl-11,15-dioxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate 1531632-44-6 C30H36O10 556.61 —— [(1S,2S,3R,4S,7R,9S,10S,12R)-4-acetyloxy-1-hydroxy-12-methoxy-9-methoxycarbonyloxy-10,14,17,17-tetramethyl-11,15-dioxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate 1531632-42-4 C32H38O12 614.647 —— [(1S,2S,3R,4S,7R,9S,10S,12R,15R,16S)-4-acetyloxy-15-hydroxy-12-methoxy-9-methoxycarbonyloxy-10,14,20,20-tetramethyl-11,18-dioxo-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-2-yl] benzoate 1531632-25-3 C33H38O14 658.656 —— 10-O-methyl-7-O-1,3-benzodithiolan-2-yl-10-DAB 1432613-43-8 C37H42O10S2 710.866 —— [(1R,2S,3R,4S,7R,9S,10S,12R,16R)-4-acetyloxy-1,16-dihydroxy-12-methoxy-9-methoxycarbonyloxy-10,14,17,17-tetramethyl-11,15-dioxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate 1531632-49-1 C32H38O13 630.646 —— [(1S,2S,3R,4S,7R,10R,12R,15R,16S)-4-acetyloxy-15-hydroxy-12-methoxy-10,14,20,20-tetramethyl-11,18-dioxo-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-2-yl] benzoate 1531632-20-8 C31H36O11 584.62 —— [(1S,2S,3R,4S,7R,9S,10S,12R)-4-acetyloxy-9-(dimethylcarbamoyloxy)-1-hydroxy-12-methoxy-10,14,17,17-tetramethyl-11,15-dioxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate 1531632-41-3 C33H41NO11 627.689 —— [(1R,2S,3R,4S,7R,9S,10S,12R,16R)-4-acetyloxy-9-(dimethylcarbamoyloxy)-1,16-dihydroxy-12-methoxy-10,14,17,17-tetramethyl-11,15-dioxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate 1531632-48-0 C33H41NO12 643.688 —— 10-methyl-7-dimethylaminocarbonyl-1,14-carbonate baccatin III 1531632-24-2 C34H41NO13 671.698 —— [(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4-acetyloxy-1-hydroxy-12-methoxy-10,14,17,17-tetramethyl-15-[(2R,3S)-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-tri(propan-2-yl)silyloxyhex-4-enoyl]oxy-11-oxo-9-triethylsilyloxy-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate 181706-07-0 C57H91NO14Si2 1070.52 —— [(1S,2S,3R,4S,7R,9S,10S,12R,16R)-4-acetyloxy-12-methoxy-9-methoxycarbonyloxy-10,14,20,20-tetramethyl-11,15,18-trioxo-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-2-yl] benzoate