O-(S-3R-hydroxydodecanoylpantetheine-4'-phosphoryl)-L-serine residue

Properties Image MNX_ID MNXM12844 reference chebi:78470 formula C26H47N3O10PS*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)CCCCCCCCC)C([*])=O MNX internals InChI (mnx) InChI=1/C28H54N3O10PS/c1-6-7-8-9-10-11-12-13-22(33)18-25(35)43-17-16-30-24(34)14-15-31-27(37)26(36)28(3,4)20-41-42(38,39)40-19-23(29-5)21(2)32/h22-23,26,29,33,36H,6-20H2,1-5H3,(H,30,34)(H,31,37)(H,38,39)/t22-,23+,26+/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][C@H:22]([CH2:18][C:25](=[O:35])[S:43][CH2:17][CH2:16][N:30]=[C:24]([CH2:14][CH2:15][N:31]=[C:27]([C@@H:26]([C:28]([CH3:3])([CH3:4])[CH2:20][O:41][P:42]([OH:38])(=[O:39])[O:40][CH2:19][C@@H:23]([C:21]([13CH3:2])=[O:32])[NH:29][13CH3:5])[OH:36])[OH:37])[OH:34])[OH:33]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 5 in models (compartimentalized) 0