3Z,7Z,10Z-Hexadecatrienoyl Coenzyme A

Properties Image Occurences in reactions MNX_ID MNXM744487 #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 4 formula C37H56N7O17P3S charge -4 mass 995.26882 reference biggM:CE2442 InChIKey ZNIIDPYHPPJCFQ-MTERJPBQSA-J InChI InChI=1S/C37H60N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-28(46)65-21-20-39-27(45)18-19-40-35(49)32(48)37(2,3)23-58-64(55,56)61-63(53,54)57-22-26-31(60-62(50,51)52)30(47)36(59-26)44-25-43-29-33(38)41-24-42-34(29)44/h8-9,11-12,15-16,24-26,30-32,36,47-48H,4-7,10,13-14,17-23H2,1-3H3,(H,39,45)(H,40,49)(H,53,54)(H,55,56)(H2,38,41,42)(H2,50,51,52)/p-4/b9-8-,12-11-,16-15-/t26?,30?,31?,32?,36-/m0/s1 SMILES CCCCC/C=C\C/C=C\CC/C=C\CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OCC1O[C@H](n2cnc3c(N)ncnc32)C(O)C1OP(=O)([O-])[O-]

Parent-child relations graph

Deprecated MNXref IDs graph