(1S,3R,5S,7R,12S,14R,16S,18R,19R,21S,23R,25S,26R,28S,30R)-5,8,18,25,28,30-hexamethyl-26-phenylmethoxy-25-(2-phenylmethoxyethyl)-2,6,11,15,20,24,29-heptaoxaheptacyclo[17.13.0.03,16.05,14.07,12.021,30.023,28]dotriacont-8-ene | 170707-15-0

分子结构分类

有机化合物 - 苯类化合物 - 苯和取代衍生物

中文名称

——

中文别名

——

英文名称

(1S,3R,5S,7R,12S,14R,16S,18R,19R,21S,23R,25S,26R,28S,30R)-5,8,18,25,28,30-hexamethyl-26-phenylmethoxy-25-(2-phenylmethoxyethyl)-2,6,11,15,20,24,29-heptaoxaheptacyclo[17.13.0.03,16.05,14.07,12.021,30.023,28]dotriacont-8-ene

英文别名

——

(1S,3R,5S,7R,12S,14R,16S,18R,19R,21S,23R,25S,26R,28S,30R)-5,8,18,25,28,30-hexamethyl-26-phenylmethoxy-25-(2-phenylmethoxyethyl)-2,6,11,15,20,24,29-heptaoxaheptacyclo[17.13.0.03,16.05,14.07,12.021,30.023,28]dotriacont-8-ene化学式

CAS

170707-15-0

化学式

C₄₇H₆₄O₉

mdl

——

分子量

773.02

InChiKey

BEPRTDHYSKYFNH-KBIAPFTJSA-N

BEILSTEIN

——

EINECS

——

计算性质

辛醇/水分配系数(LogP)：

6
重原子数：

56
可旋转键数：

8
环数：

9.0
sp3杂化的碳原子比例：

0.7
拓扑面积：

83.1
氢给体数：

0
氢受体数：

9

上下游信息

上游原料

中文名称	英文名称	CAS号	化学式	分子量
——	(1R,3S,5R,6R,7S,9R,11S,13R,18S)-6-[[(2S,3R,4aS,6R,7S,8aR)-6-ethenyl-2,4a,6-trimethyl-3-phenylmethoxy-2-(2-phenylmethoxyethyl)-4,7,8,8a-tetrahydro-3H-pyrano[3,2-b]pyran-7-yl]oxy]-7-ethenyl-5,11,14-trimethyl-2,8,12,17-tetraoxatetracyclo[9.8.0.03,9.013,18]nonadec-14-ene	889109-19-7	C₄₉H₆₆O₉	799.058
——	(1S,3R,5S,7R,12S,14R,16S,18R,19R,21S,23R,25S,26R,28S,30R)-5,8,18,25,28,30-hexamethyl-26-phenylmethoxy-25-(2-phenylmethoxyethyl)-2,6,11,15,20,24,29-heptaoxaheptacyclo[17.13.0.03,16.05,14.07,12.021,30.023,28]dotriaconta-8,31-diene	889109-21-1	C₄₇H₆₂O₉	771.004
——	(1S,3R,5S,7R,12S,14R,16S,18R,19R,21S,23R,25S,26R,28S,30R)-5,8,18,25,28,30-hexamethyl-26-phenylmethoxy-25-(2-phenylmethoxyethyl)-2,6,11,15,20,24,29-heptaoxaheptacyclo[17.13.0.03,16.05,14.07,12.021,30.023,28]dotriacont-8-en-10-one	170707-13-8	C₄₇H₆₂O₁₀	787.003
——	(2R,3S,4aR,6S,7R,8aS)-7-Benzyloxy-6-(2-benzyloxy-ethyl)-2,6,8a-trimethyl-2-vinyl-octahydro-pyrano[3,2-b]pyran-3-ol	858346-21-1	C₂₉H₃₈O₅	466.618
——	(1R,3S,5R,7S,8R,10S,12R,15S,17R,19S,20R,22S,24R)-20-[[(2S,3S)-3-ethenyloxiran-2-yl]methyl]-7,10,12,19,24-pentamethyl-8-phenylmethoxy-7-(2-phenylmethoxyethyl)-2,6,11,16,21-pentaoxapentacyclo[13.9.0.03,12.05,10.017,22]tetracosan-19-ol	161984-86-7	C₄₅H₆₂O₉	746.982
——	(1R,3S,5R,6R,7S,9R,11S,13R,16R,18S)-6-[[(2S,3R,4aS,6R,7S,8aR)-6-ethenyl-2,4a,6-trimethyl-3-phenylmethoxy-2-(2-phenylmethoxyethyl)-4,7,8,8a-tetrahydro-3H-pyrano[3,2-b]pyran-7-yl]oxy]-7-ethenyl-5,11-dimethyl-16-phenyl-2,8,12,15,17-pentaoxatetracyclo[9.8.0.03,9.013,18]nonadecane	858346-35-7	C₅₃H₆₈O₁₀	865.117
——	(1R,3S,5R,6S,8R,10S)-6-[(2R)-3-[[(2S,3R,4aS,6R,7S,8aR)-6-ethenyl-2,4a,6-trimethyl-3-phenylmethoxy-2-(2-phenylmethoxyethyl)-4,7,8,8a-tetrahydro-3H-pyrano[3,2-b]pyran-7-yl]oxy]-2-methyl-3-phenylsulfanylpropyl]-3,14-dimethyl-2,7,11-trioxatricyclo[8.4.0.03,8]tetradec-13-en-5-ol	889109-16-4	C₅₂H₆₈O₉S	869.173
——	1-[(1S,3R,5S,7S,8S,10R,12S,14R,15R,17S,19R,21S,22R,24S,26R)-8-hydroxy-5,14,21,24,26-pentamethyl-22-phenylmethoxy-21-(2-phenylmethoxyethyl)-2,6,11,16,20,25-hexaoxahexacyclo[13.13.0.03,12.05,10.017,26.019,24]octacosan-7-yl]ethanone	161984-90-3	C₄₅H₆₂O₁₀	762.981
——	tert-butyl-[[(1S,3R,5S,7R,8S,10R,12S,14R,15R,17S,19R,21S,22R,24S,26R)-7-ethenyl-5,14,21,24,26-pentamethyl-22-phenylmethoxy-21-(2-phenylmethoxyethyl)-2,6,11,16,20,25-hexaoxahexacyclo[13.13.0.03,12.05,10.017,26.019,24]octacosan-8-yl]oxy]-dimethylsilane	161984-87-8	C₅₁H₇₆O₉Si	861.245
——	(2S,3R,4aS,6R,7S,8aR)-3-(tert-Butyl-dimethyl-silanyloxy)-2-[(R)-3-(tert-butyl-dimethyl-silanyloxy)-2-methyl-propyl]-6-isopropenyl-7-(4-methoxy-benzyloxy)-4a-methyl-octahydro-pyrano[3,2-b]pyran	889109-08-4	C₃₆H₆₄O₆Si₂	649.072
——	(R)-3-[(2S,3R,4aS,8aS,9aR,10aR)-3-(tert-Butyl-dimethyl-silanyloxy)-4a,5-dimethyl-3,4,4a,7,8a,9,9a,10a-octahydro-2H-1,8,10-trioxa-anthracen-2-yl]-2-methyl-propan-1-ol	889109-11-9