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O-[S-(11Z,23Z-dotetracontadienoylpantetheine)-4'-phosphoryl]-L-serine residue

PropertiesImage
MNX_IDMNXM11014 Image of MNXM11014
referencechebi:87893
formulaC56H103N3O9PS*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)CCCCCCCCC/C=C\CCCCCCCCCC/C=C\CCCCCCCCCCCCCCCCCC)C([*])=O
MNX internals
InChI (mnx)InChI=1/C58H110N3O9PS/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-42-43-44-45-55(64)72-49-48-60-54(63)46-47-61-57(66)56(65)58(3,4)51-70-71(67,68)69-50-53(59-5)52(2)62/h23-24,35-36,53,56,59,65H,6-22,25-34,37-51H2,1-5H3,(H,60,63)(H,61,66)(H,67,68)/b24-23-,36-35-/t53-,56-/m0/s1/i2+1,5+1 Image of MNXM11014
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][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]/[CH:41]=[CH:42]/[CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52]/[CH:53]=[CH:55]\[CH2:54][CH2:56][CH2:57][CH2:58][NH:59][NH:60][NH:61][O:62][O:63][O:64][O:65][O:66][O:67][O:68][O:69][O:70][PH:71][SH:72])=[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
IdentifierDescription

CHEBI:87893
chebi:87893 		O-[S-(11Z,23Z-dotetracontadienoylpantetheine)-4'-phosphoryl]-L-serine residue
(11Z,23Z-C42:2-phosphopantetheine)-L-serine(1-) residue
O-[S-(11Z,23Z-dotetracontadienoylpantetheine)-4'-phosphoryl]-L-serine(1-) residue

metacyc.compound:cis-cis-D11-23-C42-2-ACPs
metacycM:cis-cis-D11-23-C42-2-ACPs 		a cis,cis-delta11,23-C42:2-[acp]

seed.compound:cpd28391
seedM:cpd28391 		a cis,cis-delta11,23-C42:2-[acp]
cis-cis-D11-23-C42-2-ACPs

seedM:M_cpd28391 		secondary/obsolete/fantasy identifier