13R-HpOME(11E) (CHEBI:185632)

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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	13R-HpOME(11E)

ChEBI ID	CHEBI:185632

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H34O4

Net Charge

Average Mass

314.466

Monoisotopic Mass

314.24571

InChI

InChI=1S/C18H34O4/c1-2-3-11-14-17(22-21)15-12-9-7-5-4-6-8-10-13-16-18(19)20/h12,15,17,21H,2-11,13-14,16H2,1H3,(H,19,20)/b15-12+/t17-/m1/s1

InChIKey

IJZHVZJCTHEXLZ-OKACTXMXSA-N

SMILES

O(O)[C@H](CCCCC)\C=C\CCCCCCCCCC(O)=O

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] 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	13R-HpOME(11E) (CHEBI:185632) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name

(E,13R)-13-hydroperoxyoctadec-11-enoic acid