Product Name：
3-Oxopalmitoyl-CoA
Other Names： 3-氧代棕榈酰辅酶A;β-Ketopalmitoyl-coenzyme A；S-(3-Ketohexadecanoyl)coenzyme A
CAS：34619-89-1
Other Names： 3-氧代棕榈酰辅酶A;β-Ketopalmitoyl-coenzyme A；S-(3-Ketohexadecanoyl)coenzyme A
CAS：34619-89-1
Structural Information
| Molecular Formula | C37H64N7O18P3S | Molecular Weight | 1019.93 | ||
| 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] 3-oxohexadecanethioate | ||||
| InChIKey | NQMPLXPCRJOSHL-BBECNAHFSA-N | ||||
| InChI | InChI=1S/C37H64N7O18P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-25(45)20-28(47)66-19-18-39-27(46)16-17-40-35(50)32(49)37(2,3)22-59-65(56,57)62-64(54,55)58-21-26-31(61-63(51,52)53)30(48)36(60-26)44-24-43-29-33(38)41-23-42-34(29)44/h23-24,26,30-32,36,48-49H,4-22H2,1-3H3,(H,39,46)(H,40,50)(H,54,55)(H,56,57)(H2,38,41,42)(H2,51,52,53)/t26-,30-,31-,32+,36-/m1/s1 | ||||
| SMILES | CCCCCCCCCCCCCC(=O)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 | ||||
Literature
