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

O-[S-3-oxo-(7Z-hexacosenoylpantetheine)-4'-phosphoryl]-L-serine residue

Properties Image MNX_ID MNXM11095 reference chebi:87857 formula C40H71N3O10PS*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)CCC/C=C\CCCCCCCCCCCCCCCCCC)C([*])=O MNX internals InChI (mnx) InChI=1/C42H78N3O10PS/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-36(47)32-39(49)57-31-30-44-38(48)28-29-45-41(51)40(50)42(3,4)34-55-56(52,53)54-33-37(43-5)35(2)46/h23-24,37,40,43,50H,6-22,25-34H2,1-5H3,(H,44,48)(H,45,51)(H,52,53)/b24-23-/t37-,40-/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][CH2:36][CH2:37]/[CH:38]=[O:53]/[CH2:39][CH2:40][CH2:41][CH2:42][O:52][O:50][S:57][O:55][O:54][PH:56][O:49][O:51][NH:43][NH:44][NH:45][O:46][O:47][OH:48])=[CH2:35])=[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:87857 chebi:87857	O-[S-3-oxo-(7Z-hexacosenoylpantetheine)-4'-phosphoryl]-L-serine residue 3-oxo-(7Z-C26:1-phosphopantetheine)-L-serine(1-) residue O-{S-[(7Z)-3-oxohexacosenoylpantetheine]-4'-phosphoryl}-L-serine(1-) residue
metacyc.compound:cis-delta7-3-oxo-cerotoyl-ACPs metacycM:cis-delta7-3-oxo-cerotoyl-ACPs	a (7Z)-3-oxohexacos-7-enoyl-[acp] a cis-delta7-3-oxo-C26:1-[acp]
seed.compound:cpd28464 seedM:cpd28464	a cis-delta7-3-oxo-C26:1-[acp] a (7Z)-3-oxohexacos-7-enoyl-[acp] cis-delta7-3-oxo-cerotoyl-ACPs
seedM:M_cpd28464	secondary/obsolete/fantasy identifier