CHEBI:50097 - 13-hydroperoxylinoleic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 13-hydroperoxylinoleic acid
ChEBI ID CHEBI:50097
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C18H32O4
Net Charge 0
Average Mass 312.44428
Monoisotopic Mass 312.23006
InChI InChI=1S/C18H32O4/c1-2-3-11-14-17(22-21)15-12-9-7-5-4-6-8-10-13-16-18(19)20/h7,9,15,21H,2-6,8,10-14,16H2,1H3,(H,19,20)/b9-7-,17-15?
InChIKey ITZHGZMZQUJODL-MMDKRFMXSA-N
SMILES CCCCCC(OO)=CC\C=C/CCCCCCCC(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 13-hydroperoxylinoleic acid (CHEBI:50097) has functional parent linoleic acid (CHEBI:17351)
13-hydroperoxylinoleic acid (CHEBI:50097) is a hydroperoxy polyunsaturated fatty acid (CHEBI:189832)
IUPAC Name
(9Z)-13-hydroperoxyoctadeca-9,12-dienoic acid
Synonym Source
13-Hpla ChemIDplus
Registry Numbers Types Sources
2278630 Beilstein Registry Number Beilstein
34444-18-3 CAS Registry Number ChemIDplus
Last Modified
24 January 2023