Product Name：
Dodecenoyl-CoA
Other Names： 十二碳烯酰辅酶A;Coenzyme A,S-2-dodecenoate, (Z)-;Dodecenoyl-coenzyme A
CAS：917-40-8
Other Names： 十二碳烯酰辅酶A;Coenzyme A,S-2-dodecenoate, (Z)-;Dodecenoyl-coenzyme A
CAS：917-40-8
Structural Information
| Molecular Formula | C33H56N7O17P3S | Molecular Weight | 947.82 | ||
| IUPAC Name | S-[2-[3-[[(2S)-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] (Z)-dodec-2-enethioate | ||||
| InChIKey | IRFYVBULXZMEDE-LWFZDJMLSA-N | ||||
| InChI | InChI=1S/C33H56N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-24(42)61-17-16-35-23(41)14-15-36-31(45)28(44)33(2,3)19-54-60(51,52)57-59(49,50)53-18-22-27(56-58(46,47)48)26(43)32(55-22)40-21-39-25-29(34)37-20-38-30(25)40/h12-13,20-22,26-28,32,43-44H,4-11,14-19H2,1-3H3,(H,35,41)(H,36,45)(H,49,50)(H,51,52)(H2,34,37,38)(H2,46,47,48)/b13-12-/t22-,26-,27-,28-,32-/m1/s1 | ||||
| SMILES | CCCCCCCCCC=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 | ||||
