(3E,5Z)-octadienoyl-CoA

Properties Image Occurences in reactions MNX_ID MNXM149416 #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 2 formula C29H42N7O17P3S charge -4 mass 885.15927 reference chebi:85108 InChIKey XMHCCMXYCWOYHF-GRQFGQEHSA-J InChI InChI=1S/C29H46N7O17P3S/c1-4-5-6-7-8-9-20(38)57-13-12-31-19(37)10-11-32-27(41)24(40)29(2,3)15-50-56(47,48)53-55(45,46)49-14-18-23(52-54(42,43)44)22(39)28(51-18)36-17-35-21-25(30)33-16-34-26(21)36/h5-8,16-18,22-24,28,39-40H,4,9-15H2,1-3H3,(H,31,37)(H,32,41)(H,45,46)(H,47,48)(H2,30,33,34)(H2,42,43,44)/p-4/b6-5-,8-7+/t18-,22-,23-,24+,28-/m1/s1 SMILES CC/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