CHEBI:51985 - α-linolenoyl-CoA

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ChEBI Name α-linolenoyl-CoA ChEBI ID CHEBI:51985 ChEBI ASCII Name alpha-linolenoyl-CoA Definition An octadecatrienoyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of α-linolenic acid. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C39H64N7O17P3S Net Charge 0 Average Mass 1027.94800 Monoisotopic Mass 1027.32923 InChI InChI=1S/C39H64N7O17P3S/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/h5-6,8-9,11-12,26-28,32-34,38,49-50H,4,7,10,13-25H2,1-3H3,(H,41,47)(H,42,51)(H,55,56)(H,57,58)(H2,40,43,44)(H2,52,53,54)/b6-5-,9-8-,12-11-/t28-,32-,33-,34+,38-/m1/s1 InChIKey OMKFKBGZHNJNEX-PQBHNYBOSA-N SMILES CC\C=C/C\C=C/C\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:txid10090) Source: BioModels - MODEL1507180067 See: PubMed Homo sapiens (NCBI:txid9606) See: DOI Roles Classification Chemical Role(s): acyl donor Any donor that can transfer acyl groups between molecular entities. (via acyl-CoA ) Biological Role(s): human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). View more via ChEBI Ontology ChEBI Ontology Outgoing α-linolenoyl-CoA (CHEBI:51985) has functional parent α-linolenic acid (CHEBI:27432) α-linolenoyl-CoA (CHEBI:51985) has role human metabolite (CHEBI:77746) α-linolenoyl-CoA (CHEBI:51985) has role mouse metabolite (CHEBI:75771) α-linolenoyl-CoA (CHEBI:51985) is a α-linolenoyl bioconjugate (CHEBI:76184) α-linolenoyl-CoA (CHEBI:51985) is a octadecatrienoyl-CoA (CHEBI:139576) α-linolenoyl-CoA (CHEBI:51985) is conjugate acid of α-linolenoyl-CoA(4−) (CHEBI:74034) Incoming α-linolenoyl-CoA(4−) (CHEBI:74034) is conjugate base of α-linolenoyl-CoA (CHEBI:51985) IUPAC Name 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(9Z,12Z,15Z)-octadeca-6,12,15-trienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} Synonyms Sources (9Z,12Z,15Z)-9,12,15-octadecatrienoyl-CoA ChEBI (9Z,12Z,15Z)-9,12,15-octadecatrienoyl-coenzyme A ChEBI (9Z,12Z,15Z)-Octadecatrienoyl-CoA KEGG COMPOUND (Z,Z,Z)-9,12,15-octadecatrienoyl-CoA ChEBI (Z,Z,Z)-9,12,15-octadecatrienoyl-coenzyme A ChEBI (Z,Z,Z)-octadeca-9,12,15-trienoyl-CoA ChEBI (Z,Z,Z)-octadeca-9,12,15-trienoyl-coenzyme A ChEBI all-cis-9,12,15-octadecatrienoyl-CoA ChEBI all-cis-9,12,15-octadecatrienoyl-coenzyme A ChEBI alpha-Linolenoyl-CoA KEGG COMPOUND α-linolenoyl-coenzyme A ChEBI Manual Xrefs Databases C16162 KEGG COMPOUND HMDB0006290 HMDB View more database links Citations Types Sources 12711134 PubMed citation Europe PMC 21128943 PubMed citation Europe PMC 2597132 PubMed citation Europe PMC Last Modified 02 February 2018

General Comment 2011-05-16 An intermediate in the biosynthesis of unsaturated fatty acids.