CHEBI:84457 - 5-PAHSA

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 5-PAHSA ChEBI ID CHEBI:84457 Definition A FAHFA obtained by formal condensation of the carboxy group of palmitic acid with the hydroxy group of 5-hydroxystearic 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 C34H66O4 Net Charge 0 Average Mass 538.88540 Monoisotopic Mass 538.49611 InChI InChI=1S/C34H66O4/c1-3-5-7-9-11-13-15-16-18-20-22-24-26-31-34(37)38-32(29-27-30-33(35)36)28-25-23-21-19-17-14-12-10-8-6-4-2/h32H,3-31H2,1-2H3,(H,35,36) InChIKey QBGKCWKQYJQHJX-UHFFFAOYSA-N SMILES CCCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCCCC)CCCC(O)=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Biological Role(s): human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). Application(s): anti-inflammatory agent Any compound that has anti-inflammatory effects. hypoglycemic agent A drug which lowers the blood glucose level. View more via ChEBI Ontology ChEBI Ontology Outgoing 5-PAHSA (CHEBI:84457) has functional parent hexadecanoic acid (CHEBI:15756) 5-PAHSA (CHEBI:84457) has functional parent octadecanoic acid (CHEBI:28842) 5-PAHSA (CHEBI:84457) has role anti-inflammatory agent (CHEBI:67079) 5-PAHSA (CHEBI:84457) has role human metabolite (CHEBI:77746) 5-PAHSA (CHEBI:84457) has role hypoglycemic agent (CHEBI:35526) 5-PAHSA (CHEBI:84457) is a FAHFA (CHEBI:84426) 5-PAHSA (CHEBI:84457) is a long-chain fatty acid (CHEBI:15904) 5-PAHSA (CHEBI:84457) is conjugate acid of 5-PAHSA(1−) (CHEBI:83672) Incoming 5-PAHSA(1−) (CHEBI:83672) is conjugate base of 5-PAHSA (CHEBI:84457) IUPAC Name 5-(hexadecanoyloxy)octadecanoic acid Synonyms Sources 5-(palmitoyloxy)octadecanoic acid IUPAC 5-(palmitoyloxy)stearic acid ChEBI palmitic acid-5-hydroxystearic acid ChEBI Citation Type Source 25303528 PubMed citation Europe PMC Last Modified 23 January 2015