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eicosanoyl-CoA

PropertiesImageOccurences in reactions
MNX_IDMNXM1103962Image of MNXM1103962
#reac
in my sandbox 0
in MNXref (generic)61
in models (compartimentalized) 46
formulaC41H70N7O17P3S
charge-4
mass1058.022
referencechebi:57380
InChIKeyJYLSVNBJLYCSSW-IBYUJNRCSA-J
InChIInChI=1S/C41H74N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32(50)69-25-24-43-31(49)22-23-44-39(53)36(52)41(2,3)27-62-68(59,60)65-67(57,58)61-26-30-35(64-66(54,55)56)34(51)40(63-30)48-29-47-33-37(42)45-28-46-38(33)48/h28-30,34-36,40,51-52H,4-27H2,1-3H3,(H,43,49)(H,44,53)(H,57,58)(H,59,60)(H2,42,45,46)(H2,54,55,56)/p-4/t30-,34-,35-,36+,40-/m1/s1
SMILES[CH3:1][CH2:4][CH2:5][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][C:32](=[O:50])[S:69][CH2:25][CH2:24][N:43]=[C:31]([CH2:22][CH2:23][N:44]=[C:39]([C@@H:36]([C:41]([CH3:2])([CH3:3])[CH2:27][O:62][P:68]([OH:59])(=[O:60])[O:65][P:67]([OH:57])(=[O:58])[O:61][CH2:26][C@@H:30]1[C@@H:35]([O:64][P:66]([OH:54])([OH:55])=[O:56])[C@@H:34]([OH:51])[C@H:40]([n:48]2[cH:29][n:47][c:33]3[c:37]([NH2:42])[n:45][cH:28][n:46][c:38]32)[O:63]1)[OH:52])[OH:53])[OH:49]
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Similar chemical compounds in external resources
IdentifierDescription
reactome:R-ALL-548794
reactomeM:R-ALL-548794
CHEBI:57380
chebi:57380 		eicosanoyl-CoA
3'-phosphonatoadenosine 5'-(3-{(3R)-3-hydroxy-4-[(3-{[2-(icosanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-2,2-dimethyl-4-oxobutyl} diphosphate)
eicosanoyl-CoA(4-)
icosanoyl-CoA(4-)
lipidmaps:LMFA07050329
lipidmapsM:LMFA07050329 		Arachidoyl-CoA
CoA 20:0
Eicosanoyl-CoA
icosanoyl-CoA
bigg.metabolite:arachcoa
biggM:arachcoa 		Arachidyl coenzyme A
hmdb:HMDB0004258 Eicosanoyl-CoA
Arachidinoyl-CoA
Arachidinoyl-coenzyme A
Arachidoyl coenzyme A
Arachidoyl-CoA
Arachidoyl-coenzyme A
Arachidyl CoA
Arachidyl coenzyme A
CoA(20:0)
Eicosanoyl coenzyme A
Eicosanoyl-coenzyme A
Eicosyl-CoA
Eicosyl-coenzyme A
Icosanoyl-CoA
eicosanoyl-coa
{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-3-[(2-{[2-(icosanoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]-2,2-dimethylpropoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
sabiork.compound:2363
sabiorkM:2363
kegg.compound:C02041
keggC:C02041 		Eicosanoyl-CoA
Arachidoyl-CoA
Icosanoyl-CoA
seed.compound:cpd01393
seedM:cpd01393 		Icosanoyl-CoA
Arachidoyl-CoA
Eicosanoyl-CoA
arachidoyl-CoA
eicosanoyl-CoA
icosanoyl-CoA
metacyc.compound:CPD-9965
metacycM:CPD-9965 		arachidoyl-CoA
ArachCoA
eicosanoyl-CoA
icosanoyl-CoA
vmhM:arachcoa
vmhM:arachcoa
vmhmetabolite:arachcoa
vmhmetabolite:arachcoa 		arachidyl coenzyme A
{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-3-[(2-{[2-(icosanoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]-2,2-dimethylpropoxy]phosphoryl}
SLM:000000485
slm:000000485 		eicosanoyl-CoA
CHEBI:15527
chebi:15527 		icosanoyl-CoA
3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-4-[(3-{[2-(icosanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)
Arachidoyl-CoA
Eicosanoyl-CoA
arachidoyl-CoA
eicosanoyl-CoA
hmdb:HMDB04258
chebi:14432
chebi:23900
chebi:4763
biggM:M_arachcoa
keggC:M_C02041
seedM:M_cpd01393 		secondary/obsolete/fantasy identifier