10,11-anhydro-2',4''-di-O-acetyl-12-O-(imidazol-1-ylcarbonyl)-6-O-methylerythromycin A | 217977-00-9
中文名称
——
中文别名
——
英文名称
10,11-anhydro-2',4''-di-O-acetyl-12-O-(imidazol-1-ylcarbonyl)-6-O-methylerythromycin A
英文别名
2,4-di-O-acetyl-10,11-anhydro-12-O-imidazolylcarbonyl-6-O-methylerythromycin A；10,11-anhydro-2',4"-di-O-acetyl-12-O-imidazolylcarbonyl-6-O-methylerythromycin A；[(2R,3S,4E,7R,9R,10R,11S,12S,13R)-10-[(2S,3R,4S,6R)-3-acetyloxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-12-[(2R,4R,5S,6S)-5-acetyloxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-2-ethyl-9-methoxy-3,5,7,9,11,13-hexamethyl-6,14-dioxo-1-oxacyclotetradec-4-en-3-yl] imidazole-1-carboxylate
CAS
217977-00-9
化学式
C46H73N3O15
mdl
——
分子量
908.097
InChiKey
JEICBTQWWGVABK-FNTWAYBDSA-N
BEILSTEIN
——
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：877.8±75.0 °C(Predicted)
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密度：1.23±0.1 g/cm3(Predicted)
计算性质
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辛醇/水分配系数(LogP)：5
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重原子数：64
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可旋转键数：14
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环数：4.0
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sp3杂化的碳原子比例：0.78
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拓扑面积：199
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氢给体数：0
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氢受体数：17
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 —— [(2S,3R,4S,6R)-2-[[(3R,4S,5S,6R,7R,9R,11E,13S,14R)-4-[(2R,4R,5S,6S)-5-acetyloxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-14-ethyl-13-hydroxy-7-methoxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-1-oxacyclotetradec-11-en-6-yl]oxy]-4-(dimethylamino)-6-methyloxan-3-yl] acetate 438046-02-7 C42H71NO14 814.024 —— 2',4''-di-O-acetyl-6-O-methylerythromycin A 152235-55-7 C42H73NO15 832.039 克拉霉素 clarithromycin 81103-11-9 C38H69NO13 747.965 -
下游产品
中文名称 英文名称 CAS号 化学式 分子量 —— [(2S,3R,4S,6R)-2-[[(1S,2R,5R,6S,7S,8R,9R,11R,13R,14R)-6-[(2R,4R,5S,6S)-5-acetyloxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-15-(4-azidobutyl)-2-ethyl-9-methoxy-1,5,7,9,11,13-hexamethyl-4,12,16-trioxo-3,17-dioxa-15-azabicyclo[12.3.0]heptadecan-8-yl]oxy]-4-(dimethylamino)-6-methyloxan-3-yl] acetate 849407-73-4 C47H79N5O15 954.169 —— [(2S,3R,4S,6R)-2-[[(1S,2R,5R,6S,7S,8R,9R,11R,13R,14R)-6-[(2R,4R,5S,6S)-5-acetyloxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-15-(2-aminoethyl)-2-ethyl-9-methoxy-1,5,7,9,11,13-hexamethyl-4,12,16-trioxo-3,17-dioxa-15-azabicyclo[12.3.0]heptadecan-8-yl]oxy]-4-(dimethylamino)-6-methyloxan-3-yl] acetate 213330-00-8 C45H77N3O15 900.117 —— [(2S,3R,4S,6R)-2-[[(1S,2R,5R,6S,7S,8R,9R,11R,13R,14R)-6-[(2R,4R,5S,6S)-5-acetyloxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-15-(2-amino-2-methylpropyl)-2-ethyl-9-methoxy-1,5,7,9,11,13-hexamethyl-4,12,16-trioxo-3,17-dioxa-15-azabicyclo[12.3.0]heptadecan-8-yl]oxy]-4-(dimethylamino)-6-methyloxan-3-yl] acetate 374752-09-7 C47H81N3O15 928.171 —— 4''-O-acetyl-11-amino-11-N-(2-aminoethyl)-11-deoxy-6-O-methylerythromycin A 11,12-cyclic carbamate 208456-29-5 C43H75N3O14 858.08 —— 4''-O-acetyl-11-amino-11-N-(3-aminopropyl)-11-deoxy-6-O-methylerythromycin A 11,12-cyclic carbamate 208456-43-3 C44H77N3O14 872.107 —— [(2S,3R,4S,6R)-2-[[(1S,2R,5R,6S,7S,8R,9R,11R,13R,14R)-6-[(2R,4R,5S,6S)-5-acetyloxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-15-[3-[5-[(3,5-dichloropyridin-4-yl)carbamoyl]-2-methoxyphenoxy]propyl]-2-ethyl-9-methoxy-1,5,7,9,11,13-hexamethyl-4,12,16-trioxo-3,17-dioxa-15-azabicyclo[12.3.0]heptadecan-8-yl]oxy]-6-methyl-4-(methylamino)oxan-3-yl] acetate 1266348-04-2 C58H84Cl2N4O18 1196.23 —— [(2S,3R,4S,6R)-2-[[(1S,2R,5R,6S,7S,8R,9R,11R,13R,14R)-15-(4-azidobutyl)-2-ethyl-6-hydroxy-9-methoxy-1,5,7,9,11,13-hexamethyl-4,12,16-trioxo-3,17-dioxa-15-azabicyclo[12.3.0]heptadecan-8-yl]oxy]-4-(dimethylamino)-6-methyloxan-3-yl] acetate 849407-74-5 C37H63N5O11 753.934 —— N-(3,5-dichloropyridin-4-yl)-3-[3-[(1S,2R,5R,6S,7S,8R,9R,11R,13R,14R)-2-ethyl-6-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-8-[(2S,3R,4S,6R)-3-hydroxy-6-methyl-4-(methylamino)oxan-2-yl]oxy-9-methoxy-1,5,7,9,11,13-hexamethyl-4,12,16-trioxo-3,17-dioxa-15-azabicyclo[12.3.0]heptadecan-15-yl]propoxy]-4-methoxybenzamide 1266348-05-3 C54H80Cl2N4O16 1112.15 —— 2',4''-di-O-acetyl-11-amino-9-deoxo-11-deoxy-9,11-N-(2,2-dimethyl)nitriloethano-6-O-methylerythromycin A 11,12-cyclic carbamate 374752-18-8 C47H79N3O14 910.156 —— 4''-O-acetyl-11-amino-9-deoxo-11-deoxy-9,11-N-nitriloethano-6-O-methylerythromycin A 11,12-cyclic carbamate 374752-14-4 C43H73N3O13 840.065