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CHEBI:74069 - (11Z)-eicosenoyl-CoA(4−)

ChEBI IDCHEBI:74069
ChEBI Name(11Z)-eicosenoyl-CoA(4−)
Stars
ASCII Name(11Z)-eicosenoyl-CoA(4-)
DefinitionA monounsaturated fatty acyl-CoA(4−) arising from deprotonation of the phosphate and diphosphate functions of (11Z)-eicosenoyl-CoA.
Last Modified27 July 2021
Submitterlaimo
DownloadsMolfile
FormulaC41H68N7O17P3S
Net Charge-4
Average Mass1056.016
Monoisotopic Mass1055.36272
SMILESCCCCCCCC/C=C\CCCCCCCCCC(=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/C41H72N7O17P3S/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/h11-12,28-30,34-36,40,51-52H,4-10,13-27H2,1-3H3,(H,43,49)(H,44,53)(H,57,58)(H,59,60)(H2,42,45,46)(H2,54,55,56)/p-4/b12-11-/t30-,34-,35-,36+,40-/m1/s1
InChIKeyZDRKXADSROCWCG-FVLDFCIYSA-J
ChEBI Ontology
Outgoing Relation(s)
(11Z)-eicosenoyl-CoA(4−) (CHEBI:74069) is a (11Z)-Δ11-fatty acyl-CoA(4−) (CHEBI:84947)
(11Z)-eicosenoyl-CoA(4−) (CHEBI:74069) is a 3-substituted propionyl-CoA(4−) (CHEBI:65111)
(11Z)-eicosenoyl-CoA(4−) (CHEBI:74069) is a long-chain fatty acyl-CoA(4−) (CHEBI:83139)
(11Z)-eicosenoyl-CoA(4−) (CHEBI:74069) is a monounsaturated fatty acyl-CoA(4−) (CHEBI:77331)
(11Z)-eicosenoyl-CoA(4−) (CHEBI:74069) is conjugate base of (11Z)-eicosenoyl-CoA (CHEBI:74126)
Incoming Relation(s)
(11Z)-eicosenoyl-CoA (CHEBI:74126) is conjugate acid of (11Z)-eicosenoyl-CoA(4−) (CHEBI:74069)
IUPAC Name 
3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(11Z)-icos-11-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] diphosphate}
Synonyms  Source
C20:1(n-9)-CoA(4−)SUBMITTER
(11Z)-eicosenoyl-coenzyme A(4−)SUBMITTER
(11Z)-icosenoyl-CoA(4−)SUBMITTER
11cis-eicosenoyl-CoA(4−)SUBMITTER
11cis-icosenoyl-CoA(4−)SUBMITTER
(11Z)-icosenoyl-coenzyme A(4−)ChEBI
UniProt Name  Source
(11Z)-eicosenoyl-CoAUniProt