CHEBI:53755 - 1-linolenyl-2-linoleyl-PAP

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 1-linolenyl-2-linoleyl-PAP ChEBI ID CHEBI:53755 Definition A carboxylic ester that is a modified acyl glycerol with linolenyl and linoleyl entities at C-1 and C-2, respectively; and an anilino moiety at C-3. 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 C45H71NO4 Net Charge 0 Average Mass 690.04950 Monoisotopic Mass 689.53831 InChI InChI=1S/C45H71NO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34-38-44(47)49-41-43(40-46-42-36-32-31-33-37-42)50-45(48)39-35-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,31-33,36-37,43,46H,3-4,6,8-10,15-16,21-30,34-35,38-41H2,1-2H3/b7-5-,13-11-,14-12-,19-17-,20-18- InChIKey HXBZLJYQLHNONL-LOYOHVQTSA-N SMILES CCCCC\C=C/C\C=C/CCCCCCCC(=O)OC(CNc1ccccc1)COC(=O)CCCCCCC\C=C/C\C=C/C\C=C/CC ChEBI Ontology Outgoing 1-linolenyl-2-linoleyl-PAP (CHEBI:53755) has functional parent α-linolenic acid (CHEBI:27432) 1-linolenyl-2-linoleyl-PAP (CHEBI:53755) has functional parent linoleic acid (CHEBI:17351) 1-linolenyl-2-linoleyl-PAP (CHEBI:53755) has functional parent PAP (CHEBI:53758) 1-linolenyl-2-linoleyl-PAP (CHEBI:53755) is a carboxylic ester (CHEBI:33308) Synonym Source N-{2-[(9Z,12Z)-octadeca-9,12-dien-1-yloxy]-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trien-1-yloxy]propyl}aniline ChEBI Citation Type Source 11304127 PubMed citation Europe PMC Last Modified 30 July 2014