产品名称：
3-trans,5-cis-Octadienoyl-CoA
其他名称： 3-反式，5-顺式-辛二烯酰辅酶A;Coenzyme A,S-[(3E,5Z)-3,5-octadienoate]
CAS：214769-63-8
其他名称： 3-反式，5-顺式-辛二烯酰辅酶A;Coenzyme A,S-[(3E,5Z)-3,5-octadienoate]
CAS：214769-63-8
结构信息
| 分子式 | C29H46N7O17P3S | 分子量 | 889.7 | ||
| IUPAC Name | S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 3-methylbut-2-enethioate | ||||
| InChIKey | BXIPALATIYNHJN-UHFFFAOYSA-N | ||||
| InChI | InChI=1S/C26H42N7O17P3S/c1-14(2)9-17(35)54-8-7-28-16(34)5-6-29-24(38)21(37)26(3,4)11-47-53(44,45)50-52(42,43)46-10-15-20(49-51(39,40)41)19(36)25(48-15)33-13-32-18-22(27)30-12-31-23(18)33/h9,12-13,15,19-21,25,36-37H,5-8,10-11H2,1-4H3,(H,28,34)(H,29,38)(H,42,43)(H,44,45)(H2,27,30,31)(H2,39,40,41) | ||||
| SMILES | CC(=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)C | ||||
