**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

a docosanoyl-[acp domain within a fatty acid synthase]

Properties Image MNX_ID MNXM1134930 reference metacycM:docosanoyl-TYPE-I-FAS-ACPs formula C36H67N3O9PS*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(=O)CCCCCCCCCCCCCCCCCCCCC)C([*])=O MNX internals InChI (mnx) InChI=1/C38H74N3O9PS/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-35(44)52-29-28-40-34(43)26-27-41-37(46)36(45)38(3,4)31-50-51(47,48)49-30-33(39-5)32(2)42/h33,36,39,45H,6-31H2,1-5H3,(H,40,43)(H,41,46)(H,47,48)/t33-,36-/m0/s1/i2+1,5+1 SMILES (mnx) [CH3:1][CH2:4][13CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][C:33](=[O:42])[O:50][CH2:27][CH2:26][CH2:38][C:32]([CH2:24][CH2:25][NH:39][C:35]([C@H:34]([C:36]([13CH3:2])([CH3:3])[CH2:30][O:48][O:49]([OH:45])(=[O:46])[O:47][CH2:29][C@@H:31]([C:28](=[NH:40])[PH2:51])[CH2:37][SH:52])[OH:43])=[O:44])=[NH:41]

Parent-child relations graph

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

Similar chemical compounds in external resources

Identifier	Description
metacyc.compound:docosanoyl-TYPE-I-FAS-ACPs metacycM:docosanoyl-TYPE-I-FAS-ACPs	a docosanoyl-[acp domain within a fatty acid synthase] a behenoyl-[acp]