Product Name：
(E,E)-tetradec-10,12-dienoyl-CoA
Other Names： (E,E)-tetradec-10,12-dienoyl-CoA；(10E,12E)-tetradec-10,12-dienoyl-CoA
Other Names： (E,E)-tetradec-10,12-dienoyl-CoA；(10E,12E)-tetradec-10,12-dienoyl-CoA
Structural Information
| Molecular Formula | C35H54N7O17P3S-4 | Molecular Weight | 969.8 | ||
| 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-[(10E,12E)-tetradeca-10,12-dienoyl]sulfanylethylamino]propyl]amino]butoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] phosphate | ||||
| InChIKey | NJQXLXFLYUSGAZ-NEWXNNIYSA-J | ||||
| InChI | InChI=1S/C35H58N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-26(44)63-19-18-37-25(43)16-17-38-33(47)30(46)35(2,3)21-56-62(53,54)59-61(51,52)55-20-24-29(58-60(48,49)50)28(45)34(57-24)42-23-41-27-31(36)39-22-40-32(27)42/h4-7,22-24,28-30,34,45-46H,8-21H2,1-3H3,(H,37,43)(H,38,47)(H,51,52)(H,53,54)(H2,36,39,40)(H2,48,49,50)/p-4/b5-4+,7-6+/t24-,28-,29-,30+,34-/m1/s1 | ||||
| SMILES | CC=CC=CCCCCCCCCC(=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 | ||||
