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

PropertiesImage
MNX_IDMNXM11095 Image of MNXM11095
referencechebi:87857
formulaC40H71N3O10PS*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 Image of MNXM11095
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][C:36]([CH2:32][C:39](=[O:49])[S:57][CH2:31][CH2:30][N:44]=[C:38]([CH2:28][CH2:29][N:45]=[C:41]([C@@H:40]([C:42]([CH3:3])([CH3:4])[CH2:34][O:55][P:56]([OH:52])(=[O:53])[O:54][CH2:33][C@@H:37]([C:35]([13CH3:2])=[O:46])[NH:43][13CH3:5])[OH:50])[OH:51])[OH:48])=[O:47]
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: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