a (3R)-3-hydroxytetracosanoyl-[acp domain within a fatty acid synthase]

Properties Image MNX_ID MNXM1134731 reference metacycM:R-3-hydroxylignoceroyl-TYPE-I-FAS-ACPs formula C38H71N3O10PS*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)C[C@H](O)CCCCCCCCCCCCCCCCCCCCC)C([*])=O MNX internals InChI (mnx) InChI=1/C40H78N3O10PS/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-34(45)30-37(47)55-29-28-42-36(46)26-27-43-39(49)38(48)40(3,4)32-53-54(50,51)52-31-35(41-5)33(2)44/h34-35,38,41,45,48H,6-32H2,1-5H3,(H,42,46)(H,43,49)(H,50,51)/t34-,35+,38+/m1/s1/i2+1,5+1 SMILES (mnx) [CH3:1][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][CH2:24][CH2:25][C@H:34]([CH2:30][C:37](=[O:47])[S:55][CH2:29][CH2:28][N:42]=[C:36]([CH2:26][CH2:27][N:43]=[C:39]([C@@H:38]([C:40]([CH3:3])([CH3:4])[CH2:32][O:53][P:54]([OH:50])(=[O:51])[O:52][CH2:31][C@@H:35]([C:33]([13CH3:2])=[O:44])[NH:41][13CH3:5])[OH:48])[OH:49])[OH:46])[OH:45]

Parent-child relations graph

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