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CHEBI:131955 - (5E)-tetradecenoyl-CoA

ChEBI IDCHEBI:131955
ChEBI Name(5E)-tetradecenoyl-CoA
Stars
ASCII Name(5E)-tetradecenoyl-CoA
DefinitionAn unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (5E)-tetradecenoic acid.
Last Modified5 February 2018
SubmitterSteve
DownloadsMolfile
FormulaC35H60N7O17P3S
Net Charge0
Average Mass975.886
Monoisotopic Mass975.29792
SMILESCCCCCCCC/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/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/h11-12,22-24,28-30,34,45-46H,4-10,13-21H2,1-3H3,(H,37,43)(H,38,47)(H,51,52)(H,53,54)(H2,36,39,40)(H2,48,49,50)/b12-11+/t24-,28-,29-,30+,34-/m1/s1
InChIKeyMRVDZOHJMLTLHJ-MCZZQJTKSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) - PubMed (15466478)
Roles Classification
Chemical Role:
acyl donor  Any donor that can transfer acyl groups between molecular entities.
Biological Role:
rat metabolite  Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).
ChEBI Ontology
Outgoing Relation(s)
(5E)-tetradecenoyl-CoA (CHEBI:131955) has role rat metabolite (CHEBI:86264)
(5E)-tetradecenoyl-CoA (CHEBI:131955) is a 11,12-saturated fatty acyl-CoA (CHEBI:85348)
(5E)-tetradecenoyl-CoA (CHEBI:131955) is a long-chain fatty acyl-CoA (CHEBI:33184)
(5E)-tetradecenoyl-CoA (CHEBI:131955) is a monounsaturated fatty acyl-CoA (CHEBI:139575)
(5E)-tetradecenoyl-CoA (CHEBI:131955) is conjugate acid of (5E)-tetradecenoyl-CoA(4−) (CHEBI:131943)
Incoming Relation(s)
(5E)-tetradecenoyl-CoA(4−) (CHEBI:131943) is conjugate base of (5E)-tetradecenoyl-CoA (CHEBI:131955)
IUPAC Name 
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(5E)-tetradec-5-enoyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate}
Synonyms  Source
(5E)-tetradecenoyl-coenzyme AChEBI
(E)-tetradec-5-enoyl-CoAChEBI
(E)-tetradec-5-enoyl-coenzyme AChEBI
trans-5-tetradecenoyl-CoAChEBI
trans-5-tetradecenoyl-coenzyme AChEBI
Citations