产品名称：
(2E)-tricosenoyl-CoA
其他名称： (2E)-tricosenoyl-CoA(4-)；(2E)-tricosenoyl-CoA；(2E)-tricosenoyl-coenzyme A(4-)；trans-2-tricosenoyl-coenzyme A(4-)；CHEBI:90119；Q27162329
其他名称： (2E)-tricosenoyl-CoA(4-)；(2E)-tricosenoyl-CoA；(2E)-tricosenoyl-coenzyme A(4-)；trans-2-tricosenoyl-coenzyme A(4-)；CHEBI:90119；Q27162329
结构信息
| 分子式 | C44H74N7O17P3S-4 | 分子量 | 1098.1 | ||
| IUPAC Name | [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-[2-[(E)-tricos-2-enoyl]sulfanylethylamino]propyl]amino]butoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] phosphate | ||||
| InChIKey | CAWFROVHOZZJJP-DFNRIUMZSA-J | ||||
| InChI | InChI=1S/C44H78N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-35(53)72-28-27-46-34(52)25-26-47-42(56)39(55)44(2,3)30-65-71(62,63)68-70(60,61)64-29-33-38(67-69(57,58)59)37(54)43(66-33)51-32-50-36-40(45)48-31-49-41(36)51/h23-24,31-33,37-39,43,54-55H,4-22,25-30H2,1-3H3,(H,46,52)(H,47,56)(H,60,61)(H,62,63)(H2,45,48,49)(H2,57,58,59)/p-4/b24-23+/t33-,37-,38-,39+,43-/m1/s1 | ||||
| SMILES | CCCCCCCCCCCCCCCCCCCCC=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 | ||||
