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tetracosanoyl-CoA

Properties

Image

Occurences in reactions

MNX_ID

MNXM1104012

	#reac
in my sandbox	0
in MNXref (generic)	44
in models (compartimentalized)	57

formula

C₄₅H₇₈N₇O₁₇P₃S

charge

-4

mass

1113.44097

reference

chebi:65052

InChIKey

MOYMQYZWIUKGGY-JBKAVQFISA-J

InChI

InChI=1S/C45H82N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-36(54)73-29-28-47-35(53)26-27-48-43(57)40(56)45(2,3)31-66-72(63,64)69-71(61,62)65-30-34-39(68-70(58,59)60)38(55)44(67-34)52-33-51-37-41(46)49-32-50-42(37)52/h32-34,38-40,44,55-56H,4-31H2,1-3H3,(H,47,53)(H,48,57)(H,61,62)(H,63,64)(H2,46,49,50)(H2,58,59,60)/p-4/t34-,38-,39-,40+,44-/m1/s1

SMILES

CCCCCCCCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:65052 chebi:65052	tetracosanoyl-CoA 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-({2-[(tetracosanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}butyl] diphosphate} C24:0-CoA(4-) C24:0-coenzyme A(4-) lignoceroyl-CoA(4-) tetracosanoyl-CoA (4-) tetracosanoyl-CoA(4-) tetracosanoyl-coenzyme A(4-)
bigg.metabolite:lgnccoa biggM:lgnccoa	Lignocericyl coenzyme A
hmdb:HMDB0060239	Lignocericyl coenzyme A (2R)-4-({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-2-hydroxy-3,3-dimethyl-N-(2-{[2-(tetracosanoylsulfanyl)ethyl]-C-hydroxycarbonimidoyl}ethyl)butanimidic acid (2R)-4-[({[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy(hydroxy)phosphoryl}oxy(hydroxy)phosphoryl)oxy]-2-hydroxy-3,3-dimethyl-N-(2-{[2-(tetracosanoylsulfanyl)ethyl]-C-hydroxycarbonimidoyl}ethyl)butanimidic acid C24:0-CoA C24:0-coenzyme A Lignoceroyl-CoA Lignoceroyl-coenzyme A Tetracosanoyl-coenzyme A
sabiork.compound:20028 sabiorkM:20028	Lignoceroyl-CoA
lipidmaps:LMFA07050372 lipidmapsM:LMFA07050372	Lignoceroyl-CoA C24:0-CoA C24:0-coenzyme A CoA 24:0 Lignoceroyl-coa Lignoceroyl-coenzyme A Tetracosanoyl-CoA tetracosanoyl-coenzyme A
seed.compound:cpd15297 seedM:cpd15297	Lignoceroyl-CoA Tetracosanoyl-CoA lignoceroyl-CoA tetracosanoyl-CoA ttccoa
bigg.metabolite:ttccoa biggM:ttccoa	Tetracosanoyl CoA n C240CoA
kegg.compound:C16529 keggC:C16529	Tetracosanoyl-CoA Lignoceroyl-CoA
hmdb:HMDB0006526	Tetracosanoyl-CoA Lignoceroyl-CoA Lignoceroyl-coenzyme A S-Tetracosanoate S-Tetracosanoate CoA S-Tetracosanoate coenzyme A S-Tetracosanoic acid Tetracosanoyl-coenzyme A [(2R,4S,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[({hydroxy[hydroxy(3R)-3-hydroxy-2,2-dimethyl-3-[(2-{[2-(tetracosanoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]propoxyphosphoryl]oxyphosphoryl}oxy)methyl]oxolan-3-yl]oxyphosphonic acid {[(2R,4S,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-[(2-{[2-(tetracosanoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
metacyc.compound:CPD-10280 metacycM:CPD-10280	lignoceroyl-CoA tetracosanoyl-CoA
SLM:000000416 slm:000000416	tetracosanoyl-CoA
reactome:R-ALL-390246 reactomeM:R-ALL-390246 reactome:R-ALL-548808 reactomeM:R-ALL-548808 CHEBI:52974 chebi:52974	tetracosanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-({2-[(tetracosanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}butyl] dihydrogen diphosphate} C24:0-CoA C24:0-coenzyme A Lignoceroyl-CoA Lignoceroyl-coa Lignoceroyl-coenzyme A S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] tetracosanethioate Tetracosanoyl-CoA tetracosanoyl-coenzyme A
hmdb:HMDB06526 hmdb:HMDB60239 biggM:M_lgnccoa biggM:M_ttccoa keggC:M_C16529 seedM:M_cpd15297	secondary/obsolete/fantasy identifier