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

PropertiesImage
MNX_IDMNXM11054 Image of MNXM11054
referencechebi:87885
formulaC52H95N3O9PS*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)CCCCC/C=C\CCCCCCCCCC/C=C\CCCCCCCCCCCCCCCCCC)C([*])=O
MNX internals
InChI (mnx)InChI=1/C54H102N3O9PS/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-51(60)68-45-44-56-50(59)42-43-57-53(62)52(61)54(3,4)47-66-67(63,64)65-46-49(55-5)48(2)58/h23-24,35-36,49,52,55,61H,6-22,25-34,37-47H2,1-5H3,(H,56,59)(H,57,62)(H,63,64)/b24-23-,36-35-/t49-,52-/m0/s1/i2+1,5+1 Image of MNXM11054
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]/[CH:37]=[CH:38]/[CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48]/[CH:49]=[CH:53]/[CH2:50][O:66][CH2:51][CH2:52][CH2:54][NH:55][NH:56][NH:57][O:58][O:59][O:60][O:61][O:62][O:63][O:64][O:65][PH:67][SH:68])=[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:87885
chebi:87885
O-[S-(7Z,19Z-octatriacontadienoylpantetheine)-4'-phosphoryl]-L-serine residue
(7Z,19Z-C38:2-phosphopantetheine)-L-serine(1-) residue
O-[S-(7Z,19Z-octatriacontadienoylpantetheine)-4'-phosphoryl]-L-serine(1-) residue

metacyc.compound:cis-cis-D7-19-C38-2-ACPs
metacycM:cis-cis-D7-19-C38-2-ACPs
a cis,cis-delta7,19-C38:2-[acp]

seed.compound:cpd28432
seedM:cpd28432
a cis,cis-delta7,19-C38:2-[acp]
cis-cis-D7-19-C38-2-ACPs

seedM:M_cpd28432
secondary/obsolete/fantasy identifier