产品名称：
trans-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA
其他名称： trans-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA；cis-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA; (Acyl-CoA); [M+H]+;
其他名称： trans-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA；cis-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA; (Acyl-CoA); [M+H]+;
结构信息
| 分子式 | C31H50N7O17P3S | 分子量 | 917.8 | ||
| 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] (E)-2,6-dimethyl-5-methylidenehept-2-enethioate | ||||
| InChIKey | MPYXOYHSKAAPLW-AVJOVGNRSA-N | ||||
| InChI | InChI=1S/C31H50N7O17P3S/c1-17(2)18(3)7-8-19(4)30(43)59-12-11-33-21(39)9-10-34-28(42)25(41)31(5,6)14-52-58(49,50)55-57(47,48)51-13-20-24(54-56(44,45)46)23(40)29(53-20)38-16-37-22-26(32)35-15-36-27(22)38/h8,15-17,20,23-25,29,40-41H,3,7,9-14H2,1-2,4-6H3,(H,33,39)(H,34,42)(H,47,48)(H,49,50)(H2,32,35,36)(H2,44,45,46)/b19-8+/t20-,23-,24-,25+,29-/m1/s1 | ||||
| SMILES | CC(C)C(=C)CC=C(C)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 | ||||
