O-[S-(3R-hydroxy-7Z,19Z-octatriacontadienoylpantetheine)-4'-phosphoryl]-L-serine residue

Properties Image MNX_ID MNXM11052 reference chebi:87883 formula C52H95N3O10PS*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)CCC/C=C\CCCCCCCCCC/C=C\CCCCCCCCCCCCCCCCCC)C([*])=O MNX internals InChI (mnx) InChI=1/C54H102N3O10PS/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-48(59)44-51(61)69-43-42-56-50(60)40-41-57-53(63)52(62)54(3,4)46-67-68(64,65)66-45-49(55-5)47(2)58/h23-24,35-36,48-49,52,55,59,62H,6-22,25-34,37-46H2,1-5H3,(H,56,60)(H,57,63)(H,64,65)/b24-23-,36-35-/t48-,49+,52+/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]/[CH:23]=[CH:24]\[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]/[CH:35]=[CH:36]\[CH2:37][CH2:38][CH2:39][C@H:48]([CH2:44][C:51](=[O:61])[S:69][CH2:43][CH2:42][N:56]=[C:50]([CH2:40][CH2:41][N:57]=[C:53]([C@@H:52]([C:54]([CH3:3])([CH3:4])[CH2:46][O:67][P:68]([OH:64])(=[O:65])[O:66][CH2:45][C@@H:49]([C:47]([13CH3:2])=[O:58])[NH:55][13CH3:5])[OH:62])[OH:63])[OH:60])[OH:59]

Parent-child relations graph

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