(3S,6R,7S,8S,12Z,15S,16E)-3,7-bis{[tert-butyl(dimethyl)silyl]oxy}-15-hydroxy-4,4,6,8,12,16-hexamethyl-17-(2-methyl-1,3-thiazol-4-yl)-5-oxoheptadeca-12,16-dienoic acid | 193146-26-8

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

(3S,6R,7S,8S,12Z,15S,16E)-3,7-bis{[tert-butyl(dimethyl)silyl]oxy}-15-hydroxy-4,4,6,8,12,16-hexamethyl-17-(2-methyl-1,3-thiazol-4-yl)-5-oxoheptadeca-12,16-dienoic acid

英文别名

(3S,6R,7S,8S,15S,12Z,16E)-3,7-di-(tert-butyldimethylsilyloxy)-15-hydroxy-4,4,6,8,12,16-hexamethyl-17-(2-methyl-1,3-thiazol-4-yl)-5-oxoheptadeca-12,16-dienoic acid；(3S,6R,7S,8S,12Z,15S,16E)-3,7-bis((tert-butyldimethylsilyl)oxy)-15-hydroxy-4,4,6,8,12,16-hexamethyl-17-(2-methylthiazol-4-yl)-5-oxoheptadeca-12,16-dienoic acid；(3S,6R,7S,8S,12Z,15S,16E)-3,7-bis(tert-butyldimethylsilyloxy)-15-hydroxy-4,4,6,8,12,16-hexamethyl-17-(2-methylthiazol-4-yl)-5-oxoheptadeca-12,16-dienoic acid；(3S,6R,7S,12Z,15S,16E)-3,7-Bis-{[tert-butyl(dimethyl)silyl]oxy}-15-hydroxy-4,4,6,8,12,16-hexamethyl-17-(2-methyl-1,3-thiazol-4-yl)-5-oxoheptadeca-12,16-dienoic Acid；(3S,6R,7S,8S,12Z,15S,16E)-3,7-bis[[tert-butyl(dimethyl)silyl]oxy]-15-hydroxy-4,4,6,8,12,16-hexamethyl-17-(2-methyl-1,3-thiazol-4-yl)-5-oxoheptadeca-12,16-dienoic acid

(3S,6R,7S,8S,12Z,15S,16E)-3,7-bis{[tert-butyl(dimethyl)silyl]oxy}-15-hydroxy-4,4,6,8,12,16-hexamethyl-17-(2-methyl-1,3-thiazol-4-yl)-5-oxoheptadeca-12,16-dienoic acid化学式

CAS

193146-26-8

化学式

C₃₉H₇₁NO₆SSi₂

mdl

——

分子量

738.233

InChiKey

IDHLZOWJDYQQSB-ULCRRKNHSA-N

BEILSTEIN

——

EINECS

——

物化性质

沸点：

732.7±60.0 °C(Predicted)
密度：

1.016±0.06 g/cm3(Predicted)
溶解度：

可溶于氯仿、二氯甲烷、乙醇、乙酸乙酯、甲醇、甲苯

计算性质

辛醇/水分配系数(LogP)：

10.85
重原子数：

49
可旋转键数：

21
环数：

1.0
sp3杂化的碳原子比例：

0.77
拓扑面积：

134
氢给体数：

2
氢受体数：

8

SDS

SDS：3c48d1459cbb95e0434e36d85df8251d

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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
——	(12Z,16E)-(3S,6R,7S,8S,15S)-3,7,15-tris-(tert-butyl-dimethyl-silanyloxy)-4,4,6,8,12,16-hexamethyl-17-(2-methyl-thiazol-4-yl)-5-oxo-heptadeca-12,16-dienoic acid	193146-63-3	C₄₅H₈₅NO₆SSi₃	852.495
——	(5S,8R,9S,10S,17S,Z)-9-(tert-butyldimethylsilyloxy)-5-(2-hydroxyethyl)-2,2,3,3,6,6,8,10,14,19,19,20,20-tridecamethyl-17-((E)-1-(2-methylthiazol-4-yl)prop-1-en-2-yl)-4,18-dioxa-3,19-disilahenicos-14-en-7-one	193146-53-1	C₄₅H₈₇NO₅SSi₃	838.512
——	(7S,10R,11S,12S,19S,Z)-7,11-bis(tert-butyldimethylsilyloxy)-2,2,3,3,8,8,10,12,16,21,21,22,22-tridecamethyl-19-((E)-1-(2-methylthiazol-4-yl)prop-1-en-2-yl)-4,20-dioxa-3,21-disilatricos-16-en-9-one	193146-51-9	C₅₁H₁₀₁NO₅SSi₄	952.775
——	(7S,10R,11S,12S,19S,Z)-7-(tert-butyldimethylsilyloxy)-11-hydroxy-2,2,3,3,8,8,10,12,16,21,21,22,22-tridecamethyl-19-((E)-1-(2-methylthiazol-4-yl)prop-1-en-2-yl)-4,20-dioxa-3,21-disilatricos-16-en-9-one	193146-49-5	C₄₅H₈₇NO₅SSi₃	838.512
——	(3S,6R,7S,8S,15S,12Z,16E)-3,7-di-(tert-butyldimethylsilyloxy)-4,4,6,8,12,16-hexamethyl-17-(2-methyl-1,3-thiazol-4-yl)-1-hydroxy-15-(2-trimethylsilylethoxy)methoxyheptadeca-12,16-dien-5-one	396092-47-0	C₄₅H₈₇NO₆SSi₃	854.511
——	(3S,6R,7S,8S,12Z,15S,16E)-15-(tert-butyldimethylsiloxy)-3,7-dihydroxy-4,4,6,8,12,16-hexamethyl-17-(2-methylthiazol-4-yl)-5-oxaheptadeca-12,16-dienic acid	1236206-72-6	C₃₃H₅₇NO₆SSi	623.97
——	(4R,5S,6S,10Z,13S,14E)-13-(tert-butyldimethylsiloxy)-2-{(7S)-5,5-dimethyl-4,6-dioxaspiro[2.5]oct-7-yl}-5-hydroxy-2,4,6,10,14-pentamethyl-15-(2-methylthiazol-4-yl)pentadeca-10,14-dien-3-one	1236206-70-4	C₃₈H₆₅NO₅SSi	676.089
——	(3S,6R,7S,8S,15S,12Z,16E)-1-[di-(4-methoxyphenyl)(phenyl)-methoxy]-3-tert-butyldimethylsilyloxy-7-hydroxy-4,4,6,8,12,16-hexamethyl-17-(2-methyl-1,3-thiazol-4-yl)-15-(2-trimethylsilylethoxy)-methoxyheptadeca-12,16-dien-5-one	396092-46-9	C₆₀H₉₁NO₈SSi₂	1042.62
4-[(1E,3S,5Z,8R/S,10S)-3,11-二-{[叔-丁基(二甲基)硅烷基]氧基}-2,6,10-三甲基-十一碳-1,5-二烯基]-2-甲基-1,3-噻唑	(2S,6Z,9S,10E)-1,9-Bis[(1,1-dimethylethyl)dimethylsilyloxy]-11-(2-methylthiazol-4-yl)-2,6,10-trimethyl-undeca-6,10-diene	210690-85-0	C₃₀H₅₇NO₂SSi₂	552.025
——	(2S,6Z,9S,10E)-9-{[tert-butyl(dimethyl)silyl]oxy}-2,6,10-trimethyl-11-(2-methyl-1,3-thiazol-4-yl)undeca-6,10-dienal	193146-27-9	C₂₄H₄₁NO₂SSi	435.747
(+)-(2S,6Z,9S,10E)-9-{[叔-丁基(二甲基)硅烷基]氧基}-2,6,10-三甲基-11-(2-甲基-1,3-噻唑-4-基)-十一碳-6,10-二烯-1-醇	(2S,6Z,9S,10E)-9-[(1,1-Dimethylethyl)dimethylsilyloxy]-11-(2-methylthiazol-4-yl)-2,6,10-trimethyl-undeca-6,10-dien-1-ol	210690-99-6	C₂₄H₄₃NO₂SSi	437.762
——	(4Z,7S,8E)-7-[tert-butyl(dimethyl)silyl]oxy-4,8-dimethyl-9-(2-methyl-1,3-thiazol-4-yl)nona-4,8-dien-1-ol	193146-44-0	C₂₁H₃₇NO₂SSi	395.682
——	4-[(1E,3S,5Z,10S)-3-(tert-butyldimethylsiloxy)-2,6,10-trimethyl-11-(tetrahydro-2H-pyran-2-yloxy)undeca-1,5-dienyl]-2-methylthiazole	1236206-69-1	C₂₉H₅₁NO₃SSi	521.88
——	(2E,6E)(5S)-6-methyl-7-(2-methyl-(1,3-thiazol-4-yl))-2-prop-2-enyl-5-(1,1,2,2-tetramethyl-1-silapropoxy)hepta-2,6-dien-1-ol	193146-41-7	C₂₁H₃₅NO₂SSi	393.666
(-)-(2Z,5S,6E)-5-{[叔-丁基(二甲基)硅烷基]氧基}-2,6-二甲基-7-(2-甲基-1,3-噻唑-4-基)庚-2,6-二烯-1-醇	(-)-(2Z,5S,6E)-5-{[tert-butyl(dimethyl)silyl]oxy}-2,6-dimethyl-7-(2-methyl-1,3-thiazol-4-yl)hepta-2,6-dien-1-ol	218614-16-5	C₁₉H₃₃NO₂SSi	367.628