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CoA

PropertiesImageOccurences in reactions
MNX_IDMNXM1239465Image of MNXM1239465
#reac
in my sandbox 0
in MNXref (generic)6355
in models (compartimentalized) 2906
formulaC21H32N7O16P3S
charge-4
mass763.499
referencechebi:57287
InChIKeyRGJOEKWQDUBAIZ-IBOSZNHHSA-J
InChIInChI=1S/C21H36N7O16P3S/c1-21(2,16(31)19(32)24-4-3-12(29)23-5-6-48)8-41-47(38,39)44-46(36,37)40-7-11-15(43-45(33,34)35)14(30)20(42-11)28-10-27-13-17(22)25-9-26-18(13)28/h9-11,14-16,20,30-31,48H,3-8H2,1-2H3,(H,23,29)(H,24,32)(H,36,37)(H,38,39)(H2,22,25,26)(H2,33,34,35)/p-4/t11-,14-,15-,16+,20-/m1/s1
SMILES[CH3:1][C:21]([CH3:2])([CH2:8][O:41][P:47]([OH:38])(=[O:39])[O:44][P:46]([OH:36])(=[O:37])[O:40][CH2:7][C@@H:11]1[C@@H:15]([O:43][P:45]([OH:33])([OH:34])=[O:35])[C@@H:14]([OH:30])[C@H:20]([n:28]2[cH:10][n:27][c:13]3[c:17]([NH2:22])[n:25][cH:9][n:26][c:18]32)[O:42]1)[C@H:16]([C:19](=[N:24][CH2:4][CH2:3][C:12](=[N:23][CH2:5][CH2:6][SH:48])[OH:29])[OH:32])[OH:31]
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 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:57287
chebi:57287 		CoA
3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] diphosphate}
coenzyme A(4-)
kegg.compound:C00010
keggC:C00010 		CoA
CoA-SH
Coenzyme A
seed.compound:cpd00010
seedM:cpd00010 		CoA
CoA-SH
Coenzyme A
CoenzymeA
Coenzyme_a
HS-CoA
co-A
co-A-SH
co-enzyme-A
coa
coenzyme A
bigg.metabolite:coa
biggM:coa
envipath:...855a8c21ecfd
envipathM:...855a8c21ecfd 		Coenzyme A
hmdb:HMDB0001423 Coenzyme A
18-CoA-18-oxo-Dinor-LTB4
3'-Phosphoadenosine-(5')diphospho(4')pantatheine
Acetoacetyl coenzyme A sodium salt
CoA
CoA Hydrate
CoA-SH
CoASH
Coenzym a
Depot-zeel
HSCoA
Koenzym a
Propionyl CoA
Propionyl coenzyme A
S-Propanoate
S-Propanoate CoA
S-Propanoate coenzyme A
S-Propanoic acid
S-Propionate CoA
S-Propionate coenzyme A
Zeel
[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl (3R)-3-hydroxy-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)-2,2-dimethyl-4-oxobutyl dihydrogen diphosphate
[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl (3R)-3-hydroxy-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)-2,2-dimethyl-4-oxobutyl dihydrogen diphosphoric acid
[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl (3R)-3-hydroxy-4-({3-oxo-3-[(2-sulphanylethyl)amino]propyl}amino)-2,2-dimethyl-4-oxobutyl dihydrogen diphosphate
[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl (3R)-3-hydroxy-4-({3-oxo-3-[(2-sulphanylethyl)amino]propyl}amino)-2,2-dimethyl-4-oxobutyl dihydrogen diphosphoric acid
a, Coenzyme
coenzyme A
coenzyme A Hydrate
coenzyme A-SH
coenzyme ASH
{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
sabiork.compound:1265
sabiorkM:1265 		Coenzyme A
CoA
CoA-SH
vmhM:coa
vmhmetabolite:coa 		Coenzyme A
{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphoryl}oxy)phospho
metacyc.compound:COA-GROUP
metacycM:COA-GROUP 		a coenzyme-A group
CoA
reactome:R-ALL-162743
reactomeM:R-ALL-162743
reactome:R-ALL-193514
reactomeM:R-ALL-193514
reactome:R-ALL-2485002
reactomeM:R-ALL-2485002
reactome:R-ALL-29374
reactomeM:R-ALL-29374
reactome:R-ALL-76194
reactomeM:R-ALL-76194
CHEBI:15346
chebi:15346 		coenzyme A
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] dihydrogen diphosphate}
3'-phosphoadenosine-(5')diphospho(4')pantatheine
COENZYME A
CoA
CoA-SH
CoASH
Coenzym A
Coenzyme A
HSCoA
Koenzym A
[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl (3R)-3-hydroxy-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)-2,2-dimethyl-4-oxobutyl dihydrogen diphosphate
metacyc.compound:CO-A
metacycM:CO-A 		coenzyme A
Co-A-SH
CoA
HS-CoA
envipath:...9b0cbc7ba2ae
envipathM:...9b0cbc7ba2ae 		compound 0048200
envipath:...e8259a3f2172
envipathM:...e8259a3f2172 		compound 0056158
hmdb:HMDB0062184
hmdb:HMDB01423
hmdb:HMDB62184
chebi:13294
chebi:13295
chebi:13298
chebi:23355
chebi:3771
chebi:41597
chebi:41631
chebi:741566
biggM:M_coa
keggC:M_C00010
seedM:M_cpd00010 		secondary/obsolete/fantasy identifier