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

O-[S-3-oxo-(5Z,17Z-hexatriacontadienoylpantetheine)-4'-phosphoryl]-L-serine residue

Properties Image MNX_ID MNXM11047 reference chebi:87878 formula C50H89N3O10PS*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)CC(=O)C/C=C\CCCCCCCCCC/C=C\CCCCCCCCCCCCCCCCCC)C([*])=O MNX internals InChI (mnx) InChI=1/C52H96N3O10PS/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-46(57)42-49(59)67-41-40-54-48(58)38-39-55-51(61)50(60)52(3,4)44-65-66(62,63)64-43-47(53-5)45(2)56/h23-24,35-36,47,50,53,60H,6-22,25-34,37-44H2,1-5H3,(H,54,58)(H,55,61)(H,62,63)/b24-23-,36-35-/t47-,50-/m0/s1/i2+1,5+1 SMILES (mnx) [CH2:1]([13C:2](=[CH2:3])[13CH2:5][CH2:4][CH2:6][C:8](=[CH2:7])[C@H:13]([C:11]([CH2:9][CH2:15][C:19]([CH2:16][CH2:20][C@H:21]([C:22]([CH3:23])=[CH2:25])[CH2:24][CH3:26])(=[CH2:17])[CH3:18])([CH3:10])[CH3:12])[CH3:14])[CH2:27][CH2:28][CH2:29][C:30]([CH2:31][C:33](=[CH2:34])[CH2:35]/[CH:36]=[CH:37]/[CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47]/[CH:48]=[N:55]/[CH2:49][CH2:50][CH2:51][CH2:52][NH:53][NH:54][O:56][O:57][O:58][O:59][O:60][O:61][O:62][O:63][O:64][O:65][PH:66][SH:67])=[CH2:32]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 0

Similar chemical compounds in external resources

Identifier	Description
CHEBI:87878 chebi:87878	O-[S-3-oxo-(5Z,17Z-hexatriacontadienoylpantetheine)-4'-phosphoryl]-L-serine residue 3-oxo-(5Z,17Z-C36:2-phosphopantetheine)-L-serine(1-) residue O-{S-[(5Z,17Z)-3-oxohexatriacontadienoylpantetheine]-4'-phosphoryl}-L-serine(1-) residue
metacyc.compound:cis-cis-D5-17-3-oxo-C36-2-ACPs metacycM:cis-cis-D5-17-3-oxo-C36-2-ACPs	a cis,cis-delta5,17-3-oxo-C36:2-[acp]
seed.compound:cpd28425 seedM:cpd28425	a cis,cis-delta5,17-3-oxo-C36:2-[acp] cis-cis-D5-17-3-oxo-C36-2-ACPs
seedM:M_cpd28425	secondary/obsolete/fantasy identifier