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Merck
CN

28007

Sigma-Aldrich

巴豆酰辅酶 A 三锂盐

~90% (HPLC)

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别名:
反式-2-丁烯酰辅酶 A 三锂盐
经验公式(希尔记法):
C25H37Li3N7O17P3S
分子量:
853.41
MDL编号:
UNSPSC代码:
41106305
PubChem化学物质编号:
NACRES:
NA.51

检测方案

~90% (HPLC)

质量水平

形式

solid

杂质

≤10% water

溶解性

H2O: 50 mg/mL, clear, colorless

储存温度

−20°C

SMILES字符串

[Li+].[Li+].[Li+].C\C=C\C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)([O-])=O)n2cnc3c(N)ncnc23

InChI

1S/C25H40N7O17P3S.3Li/c1-4-5-16(34)53-9-8-27-15(33)6-7-28-23(37)20(36)25(2,3)11-46-52(43,44)49-51(41,42)45-10-14-19(48-50(38,39)40)18(35)24(47-14)32-13-31-17-21(26)29-12-30-22(17)32;;;/h4-5,12-14,18-20,24,35-36H,6-11H2,1-3H3,(H,27,33)(H,28,37)(H,41,42)(H,43,44)(H2,26,29,30)(H2,38,39,40);;;/q;3*+1/p-3/b5-4+;;;/t14-,18-,19-,20+,24-;;;/m1.../s1

InChI key

LUYQFKSDLNQLEG-OUWZIDFPSA-K

应用

巴豆酰辅酶A(巴豆酰-CoA)可用作抗结核和抗疟疾药物研究的底物,帮助鉴定和表征恶性疟原虫烯酰-ACP还原酶(PfENR)等酶以及其他可能成为有效药物靶标的烯酰辅酶A还原酶。 巴豆酰-CoA可用作β-羟基酰基-酰基载体蛋白(ACP)脱水酶(FabZ)动力学研究的底物类似物。

其他说明

通过丁酰-CoA/巴豆酰-CoA组合对一般酰基-CoA脱氢酶进行氧化还原;大鼠肝微粒体反式-2-烯酰-CoA还原酶的纯化

WGK

WGK 3

闪点(°F)

Not applicable

闪点(°C)

Not applicable

个人防护装备

Eyeshields, Gloves, type N95 (US)


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A structure-based approach has been adopted to develop 2'-substituted analogs of triclosan. The Cl at position 2' in ring B of triclosan was chemically substituted with other functional groups like NH(2), NO(2) and their inhibitory potencies against PfENR were determined.
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