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O-[S-(3R-hydroxy-11Z,23Z-dotetracontadienoylpantetheine)-4'-phosphoryl]-L-serine residue

PropertiesImage
MNX_IDMNXM11012 Image of MNXM11012
referencechebi:87891
formulaC56H103N3O10PS*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)CCCCCCC/C=C\CCCCCCCCCC/C=C\CCCCCCCCCCCCCCCCCC)C([*])=O
MNX internals
InChI (mnx)InChI=1/C58H110N3O10PS/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-42-43-52(63)48-55(65)73-47-46-60-54(64)44-45-61-57(67)56(66)58(3,4)50-71-72(68,69)70-49-53(59-5)51(2)62/h23-24,35-36,52-53,56,59,63,66H,6-22,25-34,37-50H2,1-5H3,(H,60,64)(H,61,67)(H,68,69)/b24-23-,36-35-/t52-,53+,56+/m1/s1/i2+1,5+1 Image of MNXM11012
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][CH2:40][CH2:41][CH2:42][CH2:43][C@H:52]([CH2:48][C:55](=[O:65])[S:73][CH2:47][CH2:46][N:60]=[C:54]([CH2:44][CH2:45][N:61]=[C:57]([C@@H:56]([C:58]([CH3:3])([CH3:4])[CH2:50][O:71][P:72]([OH:68])(=[O:69])[O:70][CH2:49][C@@H:53]([C:51]([13CH3:2])=[O:62])[NH:59][13CH3:5])[OH:66])[OH:67])[OH:64])[OH:63]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:87891
chebi:87891
O-[S-(3R-hydroxy-11Z,23Z-dotetracontadienoylpantetheine)-4'-phosphoryl]-L-serine residue
(3R-OH-11Z,23Z-C42:2-phosphopantetheine)-L-serine(1-) residue
O-{S-[(3R,11Z,23Z)-3-hydroxydotetracontadienoylpantetheine]-4'-phosphoryl}-L-serine(1-) residue

metacyc.compound:cis-cis-D11-23-3-hydroxyC42-2-ACPs
metacycM:cis-cis-D11-23-3-hydroxyC42-2-ACPs
a cis,cis-delta11,23-3-hydroxyC42:2-[acp]
a cis,cis-delta 11,23-3-hydroxy C42:2-[acyl-carrier-protein]

seed.compound:cpd28389
seedM:cpd28389
a cis,cis-delta11,23-3-hydroxyC42:2-[acp]
a cis,cis-delta 11,23-3-hydroxy C42:2-[acyl-carrier-protein]
cis-cis-D11-23-3-hydroxyC42-2-ACPs

seedM:M_cpd28389
secondary/obsolete/fantasy identifier