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CHEBI:234365 - (9E)-myristelaidoyl-CoA(4-)

ChEBI IDCHEBI:234365
ChEBI Name(9E)-myristelaidoyl-CoA(4-)
Stars
DefinitionA monounsaturated fatty acyl-CoA resulting from the formal condensation of the thiol group of coenzyme A with the carboxy group of (9E)-tetradecenoic acid, acid known as myristelaidic acid; major species at pH 7.3.
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC35H56N7O17P3S
Net Charge-4
Average Mass971.854
Monoisotopic Mass971.26882
SMILESCCCC/C=C/CCCCCCCC(=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/C35H60N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-26(44)63-19-18-37-25(43)16-17-38-33(47)30(46)35(2,3)21-56-62(53,54)59-61(51,52)55-20-24-29(58-60(48,49)50)28(45)34(57-24)42-23-41-27-31(36)39-22-40-32(27)42/h7-8,22-24,28-30,34,45-46H,4-6,9-21H2,1-3H3,(H,37,43)(H,38,47)(H,51,52)(H,53,54)(H2,36,39,40)(H2,48,49,50)/p-4/b8-7+/t24-,28-,29-,30+,34-/m1/s1
InChIKeyGIIFECKTWKZXGU-CTUIEXSOSA-J
ChEBI Ontology
Outgoing Relation(s)
(9E)-myristelaidoyl-CoA(4-) (CHEBI:234365) has functional parent (9E)-tetradecenoic acid (CHEBI:131381)
(9E)-myristelaidoyl-CoA(4-) (CHEBI:234365) is a monounsaturated fatty acyl-CoA(4−) (CHEBI:77331)
Synonyms  Source
9E-Tetradecenoyl Coenzyme ASUBMITTER
myristelaidoyl-CoASUBMITTER
Citations