CHEBI:15534 - oleoyl-CoA

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ChEBI Name oleoyl-CoA
ChEBI ID CHEBI:15534
Definition An unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of oleic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:7743, CHEBI:14685, CHEBI:25668
Supplier Information
Download Molfile XML SDF
Formula C39H68N7O17P3S
Net Charge 0
Average Mass 1031.98148
Monoisotopic Mass 1031.361
InChI InChI=1S/C39H68N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-30(48)67-23-22-41-29(47)20-21-42-37(51)34(50)39(2,3)25-60-66(57,58)63-65(55,56)59-24-28-33(62-64(52,53)54)32(49)38(61-28)46-27-45-31-35(40)43-26-44-36(31)46/h11-12,26-28,32-34,38,49-50H,4-10,13-25H2,1-3H3,(H,41,47)(H,42,51)(H,55,56)(H,57,58)(H2,40,43,44)(H2,52,53,54)/b12-11-/t28-,32-,33-,34+,38-/m1/s1
InChIKey XDUHQPOXLUAVEE-BPMMELMSSA-N
SMILES CCCCCCCC\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]([C@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12
Metabolite of Species Details
Mus musculus (NCBI:10090) Source: BioModels - MODEL1507180067 See: PubMed
Escherichia coli (NCBI:562) See: PubMed
Roles Classification
Chemical Role(s): acyl donor
Any donor that can transfer acyl groups between molecular entities.
(via acyl-CoA )
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing oleoyl-CoA (CHEBI:15534) has functional parent coenzyme A (CHEBI:15346)
oleoyl-CoA (CHEBI:15534) has role Escherichia coli metabolite (CHEBI:76971)
oleoyl-CoA (CHEBI:15534) has role mouse metabolite (CHEBI:75771)
oleoyl-CoA (CHEBI:15534) is a unsaturated fatty acyl-CoA (CHEBI:51006)
oleoyl-CoA (CHEBI:15534) is conjugate acid of oleoyl-CoA(4−) (CHEBI:57387)
Incoming oleoyl-CoA(4−) (CHEBI:57387) is conjugate base of oleoyl-CoA (CHEBI:15534)
IUPAC Name
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(9Z)-octadec-9-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}
Synonyms Sources
(9Z)-octadec-9-enoyl-CoA ChEBI
(9Z)-octadec-9-enoyl-coenzyme A ChEBI
(9Z)-Octadecenoyl-CoA KEGG COMPOUND
cis-9-octadecenoyl-CoA ChEBI
cis-9-octadecenoyl-coenzyme A ChEBI
cis9-octadecenoyl-CoA ChEBI
cis9-octadecenoyl-coenzyme A ChEBI
Oleoyl-CoA KEGG COMPOUND
Oleoyl-coenzyme A ChemIDplus
S-[(9Z)-octadec-9-enoyl]-CoA ChEBI
S-[(9Z)-octadec-9-enoyl]-coenzyme A ChEBI
S-oleoyl-CoA ChEBI
S-Oleoylcoenzyme A ChemIDplus
Database Links Databases
C00510 KEGG COMPOUND
HMDB0001322 HMDB
View more database links
Registry Numbers Types Sources
1716-06-9 CAS Registry Number ChemIDplus
604341 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
11500518 PubMed citation Europe PMC
15604682 PubMed citation Europe PMC
9751207 PubMed citation Europe PMC
Last Modified
27 January 2016