(3Z,5E)-dodecadienoyl-CoA

Properties Image Occurences in reactions MNX_ID MNXM36088 #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 1 formula C33H50N7O17P3S charge -4 mass 941.22187 reference chebi:156333 InChIKey ARQUZFJQPYWSSL-NBLUIMTHSA-J InChI InChI=1S/C33H54N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-24(42)61-17-16-35-23(41)14-15-36-31(45)28(44)33(2,3)19-54-60(51,52)57-59(49,50)53-18-22-27(56-58(46,47)48)26(43)32(55-22)40-21-39-25-29(34)37-20-38-30(25)40/h9-12,20-22,26-28,32,43-44H,4-8,13-19H2,1-3H3,(H,35,41)(H,36,45)(H,49,50)(H,51,52)(H2,34,37,38)(H2,46,47,48)/p-4/b10-9+,12-11-/t22-,26-,27-,28+,32-/m1/s1 SMILES CCCCCC/C=C/C=C\CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-]

Parent-child relations graph

Deprecated MNXref IDs graph