CHEBI:85205 - 3-hydroxytetradecanoyl-CoA

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ChEBI Name 3-hydroxytetradecanoyl-CoA ChEBI ID CHEBI:85205 Definition A 3-hydroxy fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 3-hydroxytetradecanoic 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 C35H62N7O18P3S Net Charge 0 Average Mass 993.88900 Monoisotopic Mass 993.30849 InChI InChI=1S/C35H62N7O18P3S/c1-4-5-6-7-8-9-10-11-12-13-23(43)18-26(45)64-17-16-37-25(44)14-15-38-33(48)30(47)35(2,3)20-57-63(54,55)60-62(52,53)56-19-24-29(59-61(49,50)51)28(46)34(58-24)42-22-41-27-31(36)39-21-40-32(27)42/h21-24,28-30,34,43,46-47H,4-20H2,1-3H3,(H,37,44)(H,38,48)(H,52,53)(H,54,55)(H2,36,39,40)(H2,49,50,51)/t23?,24-,28-,29-,30+,34-/m1/s1 InChIKey OXBHKMHNDGRDCZ-JIFARLPCSA-N SMILES CCCCCCCCCCCC(O)CC(=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 Bacillus subtilis (NCBI:txid1423) of strain OKB105 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): bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. View more via ChEBI Ontology ChEBI Ontology Outgoing 3-hydroxytetradecanoyl-CoA (CHEBI:85205) has functional parent 3-hydroxytetradecanoic acid (CHEBI:85148) 3-hydroxytetradecanoyl-CoA (CHEBI:85205) has role bacterial metabolite (CHEBI:76969) 3-hydroxytetradecanoyl-CoA (CHEBI:85205) is a 11,12-saturated fatty acyl-CoA (CHEBI:85348) 3-hydroxytetradecanoyl-CoA (CHEBI:85205) is a 3-hydroxy fatty acyl-CoA (CHEBI:20060) 3-hydroxytetradecanoyl-CoA (CHEBI:85205) is a long-chain fatty acyl-CoA (CHEBI:33184) 3-hydroxytetradecanoyl-CoA (CHEBI:85205) is conjugate acid of 3-hydroxytetradecanoyl-CoA(4−) (CHEBI:84198) Incoming 3-hydroxytetradecanoyl-CoA(4−) (CHEBI:84198) is conjugate base of 3-hydroxytetradecanoyl-CoA (CHEBI:85205) IUPAC Name 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(3-hydroxytetradecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Synonyms Sources 3-hydroxymyristoyl-CoA ChEBI 3-hydroxymyristoyl-coenzyme A ChEBI 3-hydroxytetradecanoyl-coenzyme A ChEBI Manual Xref Database CPD0-1161 MetaCyc View more database links Registry Number Type Source 11195624 Reaxys Registry Number Reaxys Citation Type Source 21673922 PubMed citation Europe PMC Last Modified 31 March 2015