(3S,11Z)-3-hydroxyhexadec-11-enoyl-CoA

Properties Image Occurences in reactions MNX_ID MNXM147625 #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0 formula C37H60N7O18P3S charge -4 mass 1015.29503 reference metacycM:CPD-17814 InChIKey SHGDVNGLFXVIAK-BFVORPHASA-J InChI InChI=1S/C37H64N7O18P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-25(45)20-28(47)66-19-18-39-27(46)16-17-40-35(50)32(49)37(2,3)22-59-65(56,57)62-64(54,55)58-21-26-31(61-63(51,52)53)30(48)36(60-26)44-24-43-29-33(38)41-23-42-34(29)44/h7-8,23-26,30-32,36,45,48-49H,4-6,9-22H2,1-3H3,(H,39,46)(H,40,50)(H,54,55)(H,56,57)(H2,38,41,42)(H2,51,52,53)/p-4/b8-7-/t25-,26+,30+,31+,32-,36+/m0/s1 SMILES CCCC/C=C\CCCCCCC[C@H](O)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