产品名称：
4-Methyloct-2-enoyl-CoA
其他名称： 4-Methyloct-2-enoyl-CoA；SCHEMBL3202560；4-Methyloct-2-enoyl-CoA; (Acyl-CoA); [M+H]+;
其他名称： 4-Methyloct-2-enoyl-CoA；SCHEMBL3202560；4-Methyloct-2-enoyl-CoA; (Acyl-CoA); [M+H]+;
结构信息
| 分子式 | C30H50N7O17P3S | 分子量 | 905.7 | ||
| IUPAC Name | S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (E)-4-methyloct-2-enethioate | ||||
| InChIKey | JPCWTQBYUUPPJJ-ZWVFPPJQSA-N | ||||
| InChI | InChI=1S/C30H50N7O17P3S/c1-5-6-7-18(2)8-9-21(39)58-13-12-32-20(38)10-11-33-28(42)25(41)30(3,4)15-51-57(48,49)54-56(46,47)50-14-19-24(53-55(43,44)45)23(40)29(52-19)37-17-36-22-26(31)34-16-35-27(22)37/h8-9,16-19,23-25,29,40-41H,5-7,10-15H2,1-4H3,(H,32,38)(H,33,42)(H,46,47)(H,48,49)(H2,31,34,35)(H2,43,44,45)/b9-8+/t18?,19-,23-,24-,25+,29-/m1/s1 | ||||
| SMILES | CCCCC(C)C=CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O | ||||
