产品名称：
4-Tolylacetyl-CoA
其他名称： 4-甲苯乙酰辅酶A;4-tolylacetyl-coenzyme A；4-Tolylacetyl-coa；Coenzyme A;p-Tolylacetyl-coenzyme A
CAS：124924-92-1
其他名称： 4-甲苯乙酰辅酶A;4-tolylacetyl-coenzyme A；4-Tolylacetyl-coa；Coenzyme A;p-Tolylacetyl-coenzyme A
CAS：124924-92-1
结构信息
| 分子式 | C30H44N7O17P3S | 分子量 | 899.69 | ||
| 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-(4-methylphenyl)ethanethioate | ||||
| InChIKey | GOWLCGDSMBSDPX-FUEUKBNZSA-N | ||||
| InChI | InChI=1S/C30H44N7O17P3S/c1-17-4-6-18(7-5-17)12-21(39)58-11-10-32-20(38)8-9-33-28(42)25(41)30(2,3)14-51-57(48,49)54-56(46,47)50-13-19-24(53-55(43,44)45)23(40)29(52-19)37-16-36-22-26(31)34-15-35-27(22)37/h4-7,15-16,19,23-25,29,40-41H,8-14H2,1-3H3,(H,32,38)(H,33,42)(H,46,47)(H,48,49)(H2,31,34,35)(H2,43,44,45)/t19-,23-,24-,25+,29-/m1/s1 | ||||
| SMILES | CC1=CC=C(C=C1)CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O)O)O | ||||
