(2Z,6E)-(4S,5R,8S,9R,10S,12S,13R)-5-(tert-Butyl-dimethyl-silanyloxy)-13-[3-(2,5-dimethyl-pyrrol-1-yl)-2,5-dimethoxy-phenyl]-9,10,13-trimethoxy-4,6,8,12-tetramethyl-trideca-2,6-dienoic acid methyl ester | 123083-94-3

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

(2Z,6E)-(4S,5R,8S,9R,10S,12S,13R)-5-(tert-Butyl-dimethyl-silanyloxy)-13-[3-(2,5-dimethyl-pyrrol-1-yl)-2,5-dimethoxy-phenyl]-9,10,13-trimethoxy-4,6,8,12-tetramethyl-trideca-2,6-dienoic acid methyl ester

英文别名

methyl (2Z,4S,5R,6E,8S,9R,10S,12S,13R)-5-[tert-butyl(dimethyl)silyl]oxy-13-[3-(2,5-dimethylpyrrol-1-yl)-2,5-dimethoxyphenyl]-9,10,13-trimethoxy-4,6,8,12-tetramethyltrideca-2,6-dienoate

(2Z,6E)-(4S,5R,8S,9R,10S,12S,13R)-5-(tert-Butyl-dimethyl-silanyloxy)-13-[3-(2,5-dimethyl-pyrrol-1-yl)-2,5-dimethoxy-phenyl]-9,10,13-trimethoxy-4,6,8,12-tetramethyl-trideca-2,6-dienoic acid methyl ester化学式

CAS

123083-94-3

化学式

C₄₁H₆₇NO₈Si

mdl

——

分子量

730.07

InChiKey

VRBCKQCOTJHUCS-MTEZGDTBSA-N

BEILSTEIN

——

EINECS

——

计算性质

辛醇/水分配系数(LogP)：

9.19
重原子数：

51.0
可旋转键数：

19.0
环数：

2.0
sp3杂化的碳原子比例：

0.63
拓扑面积：

86.61
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
——	(E,2S,3R,6S,7R,8S,10S,11R)-3-[tert-butyl(dimethyl)silyl]oxy-11-[3-(2,5-dimethylpyrrol-1-yl)-2,5-dimethoxyphenyl]-7,8,11-trimethoxy-2,4,6,10-tetramethylundec-4-en-1-ol	123083-93-2	C₃₈H₆₅NO₇Si	676.022
——	(E,2R,3R,6S,7R,8S,10S,11R)-3-[tert-butyl(dimethyl)silyl]oxy-11-[3-(2,5-dimethylpyrrol-1-yl)-2,5-dimethoxyphenyl]-7,8,11-trimethoxy-2,4,6,10-tetramethylundec-4-enal	123084-07-1	C₃₈H₆₃NO₇Si	674.006
——	tert-butyl-[(E,2S,3R,6S,7R,8S,10S,11R)-3-[tert-butyl(dimethyl)silyl]oxy-11-[3-(2,5-dimethylpyrrol-1-yl)-2,5-dimethoxyphenyl]-7,8,11-trimethoxy-2,4,6,10-tetramethylundec-4-enoxy]-dimethylsilane	123115-01-5	C₄₄H₇₉NO₇Si₂	790.285
——	(E,1R,2S,4S,5R,6S,9R,10S)-9,11-bis[[tert-butyl(dimethyl)silyl]oxy]-1-[3-(2,5-dimethylpyrrol-1-yl)-2,5-dimethoxyphenyl]-1,4-dimethoxy-2,6,8,10-tetramethylundec-7-en-5-ol	123115-00-4	C₄₃H₇₇NO₇Si₂	776.258
——	tert-butyl-[(E,4S,6S,7R)-7-[3-(2,5-dimethylpyrrol-1-yl)-2,5-dimethoxyphenyl]-7-methoxy-6-methylhept-2-en-4-yl]oxy-dimethylsilane	122911-39-1	C₂₉H₄₇NO₄Si	501.782
——	methyl (2S,4S,5R)-2-[tert-butyl(dimethyl)silyl]oxy-5-[3-(2,5-dimethylpyrrol-1-yl)-2,5-dimethoxyphenyl]-5-methoxy-4-methylpentanoate	122911-37-9	C₂₈H₄₅NO₆Si	519.754
——	(2S,4S,5R)-2-[tert-butyl(dimethyl)silyl]oxy-5-[3-(2,5-dimethylpyrrol-1-yl)-2,5-dimethoxyphenyl]-5-methoxy-4-methylpentanal	122911-38-0	C₂₇H₄₃NO₅Si	489.728
——	(E,4S,6S,7R)-7-[3-(2,5-dimethylpyrrol-1-yl)-2,5-dimethoxyphenyl]-7-methoxy-6-methylhept-2-en-4-ol	122911-40-4	C₂₃H₃₃NO₄	387.519

下游产品

中文名称	英文名称	CAS号	化学式	分子量
——	(2Z,4S,5R,6E,8S,9R,10S,12S,13R)-5-tert-butyldimethylsilyloxy-13-<3'-(2'',5''-dimethylpyrrol-1''-yl)-2',5'-dimethoxy-phenyl>-9,10,13-trimethoxy-4,6,8,12-tetramethyl-2,6-tridecadien-1-ol	123115-02-6	C₄₀H₆₇NO₇Si	702.06
——	(2Z,4S,5R,6E,8S,9R,10S,12S,13R)-13-<3'-(2'',5''-dimethylpyrrol-1''-yl)-2',5'-dimethoxyphenyl>-9,10,13-trimethoxy-4,6,8,12-tetramethyl-2,6-tridecadien-1,5-diol	175356-64-6	C₃₄H₅₃NO₇	587.797
——	(2E,4Z,6S,7R,8E,10S,11R,12S,14S,15R)-15-(3-Amino-2,5-dimethoxyphenyl)-7-(tert-butyldimethylsiloxy)-11,12,15-trimethoxy-2,6,8,10,14-pentamethyl-2,4,8-pentadecatrienoic acid	123083-98-7	C₃₇H₆₃NO₈Si	677.995
——	(2Z,4S,5R,6E,8S,9R,10S,12S,13R)-13-(3-amino-2,5-dimethoxyphenyl)-5-[tert-butyl(dimethyl)silyl]oxy-9,10,13-trimethoxy-4,6,8,12-tetramethyltrideca-2,6-dien-1-ol	123083-95-4	C₃₄H₆₁NO₇Si	623.946
——	N-{3-[(7E,11Z)-(1R,2S,4S,5R,6S,9R,10S)-9-(tert-Butyl-dimethyl-silanyloxy)-1,4,5-trimethoxy-2,6,8,10-tetramethyl-13-oxo-trideca-7,11-dienyl]-2,5-dimethoxy-phenyl}-2,2,2-trifluoro-acetamide	123084-03-7	C₃₆H₅₈F₃NO₈Si	717.939
——	(2E,4Z,8E)-(6S,7R,10S,11R,12S,14S,15R)-7-(tert-Butyl-dimethyl-silanyloxy)-15-[2,5-dimethoxy-3-(2,2,2-trifluoro-acetylamino)-phenyl]-11,12,15-trimethoxy-2,6,8,10,14-pentamethyl-pentadeca-2,4,8-trienoic acid ethyl ester	123083-97-6	C₄₁H₆₆F₃NO₉Si	802.057
——	(4E,6Z,