CHEBI:27402 - (S)-3-hydroxypalmitoyl-CoA

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ChEBI Name (S)-3-hydroxypalmitoyl-CoA ChEBI ID CHEBI:27402 ChEBI ASCII Name (S)-3-hydroxypalmitoyl-CoA Definition A long-chain (3S)-hydroxy fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (S)-3-hydroxypalmitic acid. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:397, CHEBI:18752 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 C37H66N7O18P3S Net Charge 0 Average Mass 1021.94360 Monoisotopic Mass 1021.33979 InChI InChI=1S/C37H66N7O18P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-25(45)20-28(47)66-19-18-39-27(46)16-17-40-35(50)32(49)37(2,3)22-59-65(56,57)62-64(54,55)58-21-26-31(61-63(51,52)53)30(48)36(60-26)44-24-43-29-33(38)41-23-42-34(29)44/h23-26,30-32,36,45,48-49H,4-22H2,1-3H3,(H,39,46)(H,40,50)(H,54,55)(H,56,57)(H2,38,41,42)(H2,51,52,53)/t25-,26+,30+,31+,32-,36+/m0/s1 InChIKey DEHLMTDDPWDRDR-BCIKBWLNSA-N SMILES CCCCCCCCCCCCC[C@H](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 Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed Escherichia coli (NCBI:txid562) 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): Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). 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 (S)-3-hydroxypalmitoyl-CoA (CHEBI:27402) has functional parent (S)-3-hydroxypalmitic acid (CHEBI:37250) (S)-3-hydroxypalmitoyl-CoA (CHEBI:27402) has functional parent palmitoyl-CoA (CHEBI:15525) (S)-3-hydroxypalmitoyl-CoA (CHEBI:27402) has role Escherichia coli metabolite (CHEBI:76971) (S)-3-hydroxypalmitoyl-CoA (CHEBI:27402) has role Saccharomyces cerevisiae metabolite (CHEBI:75772) (S)-3-hydroxypalmitoyl-CoA (CHEBI:27402) has role human metabolite (CHEBI:77746) (S)-3-hydroxypalmitoyl-CoA (CHEBI:27402) has role mouse metabolite (CHEBI:75771) (S)-3-hydroxypalmitoyl-CoA (CHEBI:27402) is a 11,12-saturated fatty acyl-CoA (CHEBI:85348) (S)-3-hydroxypalmitoyl-CoA (CHEBI:27402) is a long-chain (3S)-hydroxy fatty acyl-CoA (CHEBI:137639) (S)-3-hydroxypalmitoyl-CoA (CHEBI:27402) is conjugate acid of (S)-3-hydroxypalmitoyl-CoA(4−) (CHEBI:62613) Incoming (S)-3-hydroxypalmitoyl-CoA(4−) (CHEBI:62613) is conjugate base of (S)-3-hydroxypalmitoyl-CoA (CHEBI:27402) IUPAC Name 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxyhexadecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Synonyms Sources (S)-3-Hydroxyhexadecanoyl-CoA KEGG COMPOUND (S)-3-hydroxyhexadecanoyl-coenzyme A ChEBI (S)-3-hydroxypalmitoyl-coenzyme A ChEBI Manual Xref Database C05258 KEGG COMPOUND View more database links Last Modified 04 July 2017