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CHEBI:83700 - 7-PAHSA(1−)

ChEBI IDCHEBI:83700
ChEBI Name7-PAHSA(1−)
Stars
ASCII Name7-PAHSA(1-)
DefinitionA long-chain fatty acid anion that is the conjugate base of 7-PAHSA, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified26 January 2015
Submitterlaimo
DownloadsMolfile
FormulaC34H65O4
Net Charge-1
Average Mass537.890
Monoisotopic Mass537.48883
SMILESCCCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)CCCCCC(=O)[O-]
InChIInChI=1S/C34H66O4/c1-3-5-7-9-11-13-14-15-16-18-20-22-27-31-34(37)38-32(29-25-23-26-30-33(35)36)28-24-21-19-17-12-10-8-6-4-2/h32H,3-31H2,1-2H3,(H,35,36)/p-1
InChIKeyUSNXMSKYBRAGPQ-UHFFFAOYSA-M
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Applications:
hypoglycemic agent  A drug which lowers the blood glucose level.
anti-inflammatory agent  Any compound that has anti-inflammatory effects.
ChEBI Ontology
Outgoing Relation(s)
7-PAHSA(1−) (CHEBI:83700) has role anti-inflammatory agent (CHEBI:67079)
7-PAHSA(1−) (CHEBI:83700) has role human metabolite (CHEBI:77746)
7-PAHSA(1−) (CHEBI:83700) has role hypoglycemic agent (CHEBI:35526)
7-PAHSA(1−) (CHEBI:83700) is a long-chain fatty acid anion (CHEBI:57560)
7-PAHSA(1−) (CHEBI:83700) is conjugate base of 7-PAHSA (CHEBI:84479)
Incoming Relation(s)
7-PAHSA (CHEBI:84479) is conjugate acid of 7-PAHSA(1−) (CHEBI:83700)
IUPAC Name 
7-(hexadecanoyloxy)octadecanoate
Synonyms  Source
palmitoyl-7-hydroxystearate ester(1−)SUBMITTER
7-(palmitoyloxy)stearateChEBI
7-(palmitoyloxy)octadecanoateIUPAC
UniProt Name  Source
hexadecanoyl-7-hydroxyoctadecanoate esterUniProt
Citations