O-[S-(2E,17Z-hexatriacontadienoylpantetheine)-4'-phosphoryl]-L-serine(1-) residue

Properties Image MNX_ID MNXM13124 reference chebi:87918 formula C50H91N3O9PS*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/CCCCCCCCCCCCC/C=C\CCCCCCCCCCCCCCCCCC)C([*])=O MNX internals InChI (mnx) InChI=1/C52H98N3O9PS/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-49(58)66-43-42-54-48(57)40-41-55-51(60)50(59)52(3,4)45-64-65(61,62)63-44-47(53-5)46(2)56/h23-24,38-39,47,50,53,59H,6-22,25-37,40-45H2,1-5H3,(H,54,57)(H,55,60)(H,61,62)/b24-23-,39-38+/t47-,50-/m0/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]/[CH:23]=[CH:24]\[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37]/[CH:38]=[CH:39]/[C:49](=[O:58])[S:66][CH2:43][CH2:42][N:54]=[C:48]([CH2:40][CH2:41][N:55]=[C:51]([C@@H:50]([C:52]([CH3:3])([CH3:4])[CH2:45][O:64][P:65]([OH:61])(=[O:62])[O:63][CH2:44][C@@H:47]([C:46]([13CH3:2])=[O:56])[NH:53][13CH3:5])[OH:59])[OH:60])[OH:57]

Parent-child relations graph

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