Terminology Service for NFDI4Health
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9-PAHSA

Go to external page http://purl.obolibrary.org/obo/CHEBI_84425

A FAHFA (fatty acid ester of a hydroxy fatty acid) obtained by formal condensation of the carboxy group of palmitic acid with the hydroxy group of 9-hydroxyoctadecanoic acid (9-hydroxystearic acid).

Term info

Label

9-PAHSA

Synonyms
  • 9-(hexadecanoyloxy)octadecanoic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
9-(hexadecanoyloxy)octadecanoic acid [ IUPAC ]

charge

0

formula

C34H66O4

has obo namespace

chebi_ontology

has related synonym

9-(palmitoyloxy)stearic acid, 9-(palmitoyloxy)octadecanoic acid, palmitic acid-9-hydroxystearic acid

id

CHEBI:84425

inchi

InChI=1S/C34H66O4/c1-3-5-7-9-11-12-13-14-15-16-18-23-27-31-34(37)38-32(28-24-20-17-10-8-6-4-2)29-25-21-19-22-26-30-33(35)36/h32H,3-31H2,1-2H3,(H,35,36)

inchikey

MHQWHZLXDBVXML-UHFFFAOYSA-N

mass

538.887

monoisotopicmass

538.49611

smiles

O(C(CCCCCCCCCCCCCCC)=O)C(CCCCCCCCC)CCCCCCCC(=O)O