(10E,12Z)-9-Hydroperoxy-10,12-octadecadienoic acid (CHEBI:177850)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	(10E,12Z)-9-Hydroperoxy-10,12-octadecadienoic acid

ChEBI ID	CHEBI:177850

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H32O4

Net Charge

Average Mass

312.450

Monoisotopic Mass

312.23006

InChI

InChI=1S/C18H32O4/c1-2-3-4-5-6-8-11-14-17(22-21)15-12-9-7-10-13-16-18(19)20/h6,8,11,14,17,21H,2-5,7,9-10,12-13,15-16H2,1H3,(H,19,20)/b8-6-,14-11+

InChIKey

JGUNZIWGNMQSBM-ZJHFMPGASA-N

SMILES

O(O)C(CCCCCCCC(O)=O)/C=C/C=C\CCCCC

Metabolite of Species	Details
Sus scrofa (NCBI:txid9823)	Found in sausage (ENVO:00002166). See: MetaboLights Study

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	(10E,12Z)-9-Hydroperoxy-10,12-octadecadienoic acid (CHEBI:177850) is a hydroperoxy polyunsaturated fatty acid (CHEBI:189832) (10E,12Z)-9-Hydroperoxy-10,12-octadecadienoic acid (CHEBI:177850) is a octadecadienoic acid (CHEBI:25627)

IUPAC Name

(10E,12Z)-9-hydroperoxyoctadeca-10,12-dienoic acid

Synonym	Source
(+/-)9-HpODE	ChEBI

Registry Number	Type	Source
5502-91-0	CAS Registry Number	ChemIDplus

Last Modified

24 February 2023