产品名称：
2-Fluorooctanoyl-CoA
其他名称： 2-氟辛酰辅酶A;2-Fluorooctanoyl-coa；2-Fluorooctanoyl-coenzyme A；Coenzyme A, S-(2-fluorooctanoate)
CAS：149542-22-3
其他名称： 2-氟辛酰辅酶A;2-Fluorooctanoyl-coa；2-Fluorooctanoyl-coenzyme A；Coenzyme A, S-(2-fluorooctanoate)
CAS：149542-22-3
结构信息
| 分子式 | C29H49N7O17FP3S | 分子量 | 911.72 | ||
| 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] 2-fluorooctanethioate | ||||
| InChIKey | NLNZPKJACJFNFU-PMDCUQHOSA-N | ||||
| InChI | InChI=1S/C29H49FN7O17P3S/c1-4-5-6-7-8-17(30)28(42)58-12-11-32-19(38)9-10-33-26(41)23(40)29(2,3)14-51-57(48,49)54-56(46,47)50-13-18-22(53-55(43,44)45)21(39)27(52-18)37-16-36-20-24(31)34-15-35-25(20)37/h15-18,21-23,27,39-40H,4-14H2,1-3H3,(H,32,38)(H,33,41)(H,46,47)(H,48,49)(H2,31,34,35)(H2,43,44,45)/t17?,18-,21-,22-,23+,27-/m1/s1 | ||||
| SMILES | CCCCCCC(C(=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)F | ||||
