10-trans-heptadecenoyl-CoA

Properties Image Occurences in reactions MNX_ID MNXM148603 #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0 formula C38H62N7O17P3S charge -4 mass 1013.31577 reference metacycM:CPD-15650 InChIKey KFMWWNZRDBMYES-HEVZYKJKSA-J InChI InChI=1S/C38H66N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-29(47)66-22-21-40-28(46)19-20-41-36(50)33(49)38(2,3)24-59-65(56,57)62-64(54,55)58-23-27-32(61-63(51,52)53)31(48)37(60-27)45-26-44-30-34(39)42-25-43-35(30)45/h9-10,25-27,31-33,37,48-49H,4-8,11-24H2,1-3H3,(H,40,46)(H,41,50)(H,54,55)(H,56,57)(H2,39,42,43)(H2,51,52,53)/p-4/b10-9+/t27-,31-,32-,33+,37-/m1/s1 SMILES CCCCCC/C=C/CCCCCCCCC(=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