2,2-Dimethyl-propionic acid (E)-(2S,3S)-6-benzenesulfonyl-6-[(2S,4S,6R,8R,9S)-8-((S)-sec-butyl)-4-(tert-butyl-dimethyl-silanyloxy)-9-methyl-1,7-dioxa-spiro[5.5]undec-10-en-2-yl]-2,4-dimethyl-3-(2-trimethylsilanyl-ethoxymethoxy)-hex-4-enyl ester | 125024-21-7

分子结构分类

有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质

中文名称

——

中文别名

——

英文名称

2,2-Dimethyl-propionic acid (E)-(2S,3S)-6-benzenesulfonyl-6-[(2S,4S,6R,8R,9S)-8-((S)-sec-butyl)-4-(tert-butyl-dimethyl-silanyloxy)-9-methyl-1,7-dioxa-spiro[5.5]undec-10-en-2-yl]-2,4-dimethyl-3-(2-trimethylsilanyl-ethoxymethoxy)-hex-4-enyl ester

英文别名

——

2,2-Dimethyl-propionic acid (E)-(2S,3S)-6-benzenesulfonyl-6-[(2S,4S,6R,8R,9S)-8-((S)-sec-butyl)-4-(tert-butyl-dimethyl-silanyloxy)-9-methyl-1,7-dioxa-spiro[5.5]undec-10-en-2-yl]-2,4-dimethyl-3-(2-trimethylsilanyl-ethoxymethoxy)-hex-4-enyl ester化学式

CAS

125024-21-7

化学式

C₄₅H₇₈O₉SSi₂

mdl

——

分子量

851.346

InChiKey

DUMGPHJATRDLBH-VQCRLNELSA-N

BEILSTEIN

——

EINECS

——

计算性质

辛醇/水分配系数(LogP)：

10.6
重原子数：

57.0
可旋转键数：

18.0
环数：

3.0
sp3杂化的碳原子比例：

0.76
拓扑面积：

106.59
氢给体数：

0.0
氢受体数：

9.0

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
——	2,2-Dimethyl-propionic acid (E)-(2S,3S)-6-benzenesulfonyl-6-[(2S,4S,6R,8R,9S)-8-((S)-sec-butyl)-4-hydroxy-9-methyl-1,7-dioxa-spiro[5.5]undec-10-en-2-yl]-2,4-dimethyl-3-(2-trimethylsilanyl-ethoxymethoxy)-hex-4-enyl ester	125024-20-6	C₃₉H₆₄O₉SSi	737.083
——	2,2-Dimethyl-propionic acid (E)-(2S,3S)-6-benzenesulfonyl-6-[(2S,4S,6R,8R,9S)-8-((S)-sec-butyl)-4-(4-methoxy-benzyloxy)-9-methyl-1,7-dioxa-spiro[5.5]undec-10-en-2-yl]-2,4-dimethyl-3-(2-trimethylsilanyl-ethoxymethoxy)-hex-4-enyl ester	125048-93-3	C₄₇H₇₂O₁₀SSi	857.234
——	2,2-Dimethyl-propionic acid (E)-(2S,3S)-6-benzenesulfinyl-6-[(2S,4S,6R,8R,9S)-8-((S)-sec-butyl)-4-(4-methoxy-benzyloxy)-9-methyl-1,7-dioxa-spiro[5.5]undec-10-en-2-yl]-2,4-dimethyl-3-(2-trimethylsilanyl-ethoxymethoxy)-hex-4-enyl ester	125024-19-3	C₄₇H₇₂O₉SSi	841.235
——	2,2-Dimethyl-propionic acid (E)-(2S,3S)-6-[(2S,4S,6S,8R,9S)-8-((S)-sec-butyl)-4-(4-methoxy-benzyloxy)-9-methyl-1,7-dioxa-spiro[5.5]undec-10-en-2-yl]-2-methyl-4-oxo-3-(2-trimethylsilanyl-ethoxymethoxy)-hex-5-enyl ester	125024-17-1	C₄₀H₆₄O₉Si	717.028
——	2,2-Dimethyl-propionic acid (2S,3S)-6-[(2S,4S,6R,8R,9S)-8-((S)-sec-butyl)-4-(4-methoxy-benzyloxy)-9-methyl-1,7-dioxa-spiro[5.5]undec-10-en-2-yl]-6-hydroxy-2-methyl-4-oxo-3-(2-trimethylsilanyl-ethoxymethoxy)-hexyl ester	125024-16-0	C₄₀H₆₆O₁₀Si	735.044
——	2,2-Dimethyl-propionic acid (E)-(2S,3S)-6-[(2S,4S,6S,8R,9S)-8-((S)-sec-butyl)-4-(4-methoxy-benzyloxy)-9-methyl-1,7-dioxa-spiro[5.5]undec-10-en-2-yl]-4-hydroxy-2,4-dimethyl-3-(2-trimethylsilanyl-ethoxymethoxy)-hex-5-enyl ester	125024-18-2	C₄₁H₆₈O₉Si	733.071

下游产品

中文名称	英文名称	CAS号	化学式	分子量
——	(E)-(2S,3S)-6-Benzenesulfonyl-6-[(2S,4S,6R,8R,9S)-8-((S)-sec-butyl)-4-(tert-butyl-dimethyl-silanyloxy)-9-methyl-1,7-dioxa-spiro[5.5]undec-10-en-2-yl]-2,4-dimethyl-3-(2-trimethylsilanyl-ethoxymethoxy)-hex-4-en-1-ol	125024-22-8	C₄₀H₇₀O₈SSi₂	767.228
——	(2R,3S,6S,8R,10S)-8-[(2E,6E)-(4S,5S)-8-Benzenesulfonyl-3,5-dimethyl-4-(2-trimethylsilanyl-ethoxymethoxy)-octa-2,6-dienyl]-2-((S)-sec-butyl)-10-(tert-butyl-dimethyl-silanyloxy)-3-methyl-1,7-dioxa-spiro[5.5]undec-4-ene	125024-28-4	C₄₂H₇₂O₇SSi₂	777.266
——	(E,2S,3S)-6-[(2R,3S,6S,8R,10S)-2-[(2S)-butan-2-yl]-10-[tert-butyl(dimethyl)silyl]oxy-3-methyl-1,7-dioxaspiro[5.5]undec-4-en-8-yl]-2,4-dimethyl-3-(2-trimethylsilylethoxymethoxy)hex-4-en-1-ol	125024-23-9	C₃₄H₆₆O₆Si₂	627.065
——	(2E,6E)-(4S,5S)-8-[(2R,4S,6S,8R,9S)-8-((S)-sec-Butyl)-4-(tert-butyl-dimethyl-silanyloxy)-9-methyl-1,7-dioxa-spiro[5.5]undec-10-en-2-yl]-4,6-dimethyl-5-(2-trimethylsilanyl-ethoxymethoxy)-octa-2,6-dienoic acid methyl ester	125024-25-1	C₃₇H₆₈O₇Si₂	681.114
——	(E)-(2R,3S)-6-[(2R,4S,6S,8R,9S)-8-((S)-sec-Butyl)-4-(tert-butyl-dimethyl-silanyloxy)-9-methyl-1,7-dioxa-spiro[5.5]undec-10-en-2-yl]-2,4-dimethyl-3-(2-trimethylsilanyl-ethoxymethoxy)-hex-4-enal	125024-24-0	C₃₄H₆₄O₆Si₂	625.05
——	(2E,6E)-(4S,5S)-8-[(2R,4S,6S,8R,9S)-8-((S)-sec-Butyl)-4-(tert-butyl-dimethyl-silanyloxy)-9-methyl-1,7-dioxa-spiro[5.5]undec-10-en-2-yl]-4,6-dimethyl-5-(2-trimethylsilanyl-ethoxymethoxy)-octa-2,6-dien-1-ol	125024-26-2	C₃₆H₆₈O₆Si₂	653.103
——	(2R,3S,6S,8R,10S)-2-((S)-sec-Butyl)-10-(tert-butyl-dimethyl-silanyloxy)-8-[(2E,6E)-(4S,5S)-8-chloro-3,5-dimethyl-4-(2-trimethylsilanyl-ethoxymethoxy)-octa-2,6-dienyl]-3-methyl-1,7-dioxa-spiro[5.5]undec-4-ene	125024-27-3	C₃₆H₆₇ClO₅Si₂	671.549