an acetyl-[acp domain within a fatty acid synthase]

Properties Image MNX_ID MNXM1089658 reference metacycM:Acetyl-TYPE-I-FAS-ACP formula C16H27N3O9PS*2 global charge -1 mol weight   InChIKey   InChI   SMILES [*]N[C@@H](COP(=O)([O-])OCC(C)(C)[C@@H](O)C(=O)NCCC(=O)NCCSC(C)=O)C([*])=O MNX internals InChI (mnx) InChI=1/C18H34N3O9PS/c1-12(22)14(19-5)10-29-31(27,28)30-11-18(3,4)16(25)17(26)21-7-6-15(24)20-8-9-32-13(2)23/h14,16,19,25H,6-11H2,1-5H3,(H,20,24)(H,21,26)(H,27,28)/t14-,16-/m0/s1/i1+1,5+1 SMILES (mnx) [13CH3:1][C:12]([C@H:14]([CH2:10][O:29][P:31]([OH:27])(=[O:28])[O:30][CH2:11][C:18]([CH3:3])([CH3:4])[C@H:16]([C:17](=[N:21][CH2:7][CH2:6][C:15](=[N:20][CH2:8][CH2:9][S:32][C:13]([CH3:2])=[O:23])[OH:24])[OH:26])[OH:25])[NH:19][13CH3:5])=[O:22]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0