4'-demethyl-4'-O-(benzoyloxycarbonyl)epipodophyllotoxin | 23363-33-9
分子结构分类
中文名称
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中文别名
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英文名称
4'-demethyl-4'-O-(benzoyloxycarbonyl)epipodophyllotoxin
英文别名
4'-benzyloxycarbonyl-epipodophyllotoxin；[4-[(5S,5aR,8aR,9R)-5-hydroxy-8-oxo-5a,6,8a,9-tetrahydro-5H-isobenzofuro[6,5-f][1,3]benzodioxol-9-yl]-2,6-dimethoxy-phenyl] benzyl carbonate；[4-[(5S,5aR,8aR,9R)-5-hydroxy-8-oxo-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-9-yl]-2,6-dimethoxyphenyl] benzyl carbonate
CAS
23363-33-9
化学式
C29H26O10
mdl
——
分子量
534.519
InChiKey
LUYISNCEMZUKLT-QNMIOERPSA-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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熔点：202-205 °C(Solv: methanol (67-56-1))
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沸点：744.9±60.0 °C(Predicted)
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密度：1.395±0.06 g/cm3(Predicted)
计算性质
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辛醇/水分配系数(LogP)：3.7
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重原子数：39
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可旋转键数：8
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环数：6.0
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sp3杂化的碳原子比例：0.31
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拓扑面积：119
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氢给体数：1
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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 鬼臼毒素 podofilox 518-28-5 C22H22O8 414.412 4'-去甲基表鬼臼毒素 4'-demethylepipodophyllotoxin 6559-91-7 C21H20O8 400.385 -
下游产品
中文名称 英文名称 CAS号 化学式 分子量 —— 4'-benzyloxycarbonyl-4'-demethylepipodophyllotoxin 4-[N-(3-chloropropyl)]carbamate 845863-27-6 C33H32ClNO11 654.07 —— 4'-benzyloxycarbonyl-4'-demethylepipodophyllotoxin 4-[N-[3-(N',N'-dimethylaminopropyl)]]carbamate 845863-25-4 C35H38N2O11 662.694 —— 4'-benzyloxycarbonyl-4'-demethylepipodophyllotoxin 4-[N-[2-(N',N'-dimethylaminoethyl)]]carbamate 845863-23-2 C34H36N2O11 648.667 —— 4'-demethylepipodophyllotoxin ethyl ether 102306-95-6 C23H24O8 428.439 —— 4'-benzyloxycarbonyl-4'-demethylepipodophyllotoxin 4-[N-(3-azidopropyl)]carbamate 845863-29-8 C33H32N4O11 660.637 —— 4'-benzyloxycarbonyl-4'-demethylepipodophyllotoxin 4-(p-nitrophenyl)carbonate 845863-22-1 C36H29NO14 699.625 —— 4'-benzyloxycarbonyl-4'-demethylepipodophyllotoxin 4-[N-[3-(N',N'-dimethylaminopropyl)]-N-methyl]carbamate 845863-26-5 C36H40N2O11 676.72 —— 4'-benzyloxycarbonyl-4'-demethylepipodophyllotoxin 4-[N-(3-chloropropyl)-N-methyl]carbamate 845863-28-7 C34H34ClNO11 668.097 —— 4'-benzyloxycarbonyl-4'-demethylepipodophyllotoxin 4-[N-[2-(N',N'-dimethylaminoethyl)]-N-methyl]carbamate 845863-24-3 C35H38N2O11 662.694 —— 4'-benzyloxycarbonyl-4'-demethylepipodophyllotoxin 4-[N-(3-azidopropyl)-N-methyl]carbamate 845863-30-1 C34H34N4O11 674.664 —— 4'-O-demethyl-4β-(4''-hydroxyphenyl)podophyllotoxin 127882-82-0 C27H24O9 492.482 —— 4'-demethylepipodophyllotoxin-4β-[N-(n-propyl)]carbamate —— C25H27NO9 485.491 —— 4'-O-demethyl-4β-(4''-fluorophenyl)podophyllotoxin 127882-81-9 C27H23FO8 494.473 —— 4'-demethylepipodophyllotoxin-4β-(N-cyclopropyl)carbamate —— C25H25NO9 483.475 —— 4'-demethylepipodophyllotoxin-4β-(N-cyclohexyl)carbamate —— C28H31NO9 525.555 —— [4-[(5S,5aR,8aR,9R)-5-[[(2R,4aR,6R,7R,8S,8aR)-2-methyl-7,8-bis(phenylmethoxy)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-8-oxo-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-9-yl]-2,6-dimethoxyphenyl] benzyl carbonate 270928-23-9 C51H50O15 902.949 —— 4-O-(3"-azido-2",3"-dideoxy-α-D-arabino-hexopyranosyl)-4'-benzyloxycarbonyl-epipodophyllotoxin 215935-15-2 C35H35N3O13 705.675 —— 4-O-(3"-azido-2",3"-dideoxy-β-D-ribo-hexopyranosyl)-4'-benzyloxycarbonyl-epipodophyllotoxin 215935-13-0 C35H35N3O13 705.675 —— 4β-amino-4-deoxy-4'-benzyloxycarbonyl-4'-demethylepipodophyllotoxin 197016-31-2 C29H27NO9 533.535 —— 4-O-(3"-amino-2",3",6"-trideoxy-β-D-ribo-hexopyranosyl)-epipodophyllotoxin —— C27H31NO10 529.544 依托泊苷 etoposide 33419-42-0 C29H32O13 588.565 —— 4-O-(3",6"-diazido-2",3",6"-trideoxy-β-D-ribo-hexopyranosyl)-4'-benzyloxycarbonyl-epipodophyllotoxin 189454-74-8 C35H34N6O12 730.688 —— 4-O-(3",6"-diamino-2",3",6"-trideoxy-β-D-ribo-hexopyranosyl)-epipodophyllotoxin —— C27H32N2O10 544.558 —— 4-O-(3"-azido-2",3"-dideoxy-4",6"-O-ethylidene-β-D-ribo-hexopyranosyl)-epipodophyllotoxin —— C29H33NO11 571.581 —— 4-O-(3"-amino-2",3"-dideoxy-4",6"-O-ethylidene-β-D-arabino-hexopyranosyl)-epipodophyllotoxin 189454-48-6 C29H33NO11 571.581