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CHEBI:57368 - arachidonoyl-CoA(4−)

ChEBI IDCHEBI:57368
ChEBI Namearachidonoyl-CoA(4−)
Stars
ASCII Namearachidonoyl-CoA(4-)
DefinitionAn acyl-CoA(4−) arising from deprotonation of the phosphate and diphosphate functions of arachidonoyl-CoA.
Last Modified31 March 2015
DownloadsMolfile
FormulaC41H62N7O17P3S
Net Charge-4
Average Mass1049.968
Monoisotopic Mass1049.31577
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=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-]
InChIInChI=1S/C41H66N7O17P3S/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/h8-9,11-12,14-15,17-18,28-30,34-36,40,51-52H,4-7,10,13,16,19-27H2,1-3H3,(H,43,49)(H,44,53)(H,57,58)(H,59,60)(H2,42,45,46)(H2,54,55,56)/p-4/b9-8-,12-11-,15-14-,18-17-/t30-,34-,35-,36+,40-/m1/s1
InChIKeyJDEPVTUUCBFJIW-YQVDHACTSA-J
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
arachidonoyl-CoA(4−) (CHEBI:57368) has role human metabolite (CHEBI:77746)
arachidonoyl-CoA(4−) (CHEBI:57368) is a (11Z)-Δ11-fatty acyl-CoA(4−) (CHEBI:84947)
arachidonoyl-CoA(4−) (CHEBI:57368) is a polyunsaturated fatty acyl-CoA(4−) (CHEBI:77330)
arachidonoyl-CoA(4−) (CHEBI:57368) is conjugate base of arachidonoyl-CoA (CHEBI:15514)
Incoming Relation(s)
arachidonoyl-CoA (CHEBI:15514) is conjugate acid of arachidonoyl-CoA(4−) (CHEBI:57368)
IUPAC Names 
3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate}
S-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]-coenzyme A(4−)
Synonyms  Source
C20:4-CoA(4−)ChEBI
cis-Δ5,8,11,14-eicosatetraenoyl-coenzyme A(4−)ChEBI
cis-Δ5,8,11,14-eicosatetraenoyl-CoA(4−)ChEBI
arachidonoyl-coenzyme A(4−)ChEBI
arachidonyl-coenzyme A(4−)ChEBI
(5Z,8Z,11Z,14Z)-5,8,11,14-eicosatetraenoyl-CoA(4−)ChEBI
UniProt Name  Source
(5Z,8Z,11Z,14Z)-eicosatetraenoyl-CoAUniProt