11-methoxy-12,13-epoxy-9-octadecenoic acid (CHEBI:187473)

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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	11-methoxy-12,13-epoxy-9-octadecenoic acid

ChEBI ID	CHEBI:187473

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C19H34O4

Net Charge

Average Mass

326.477

Monoisotopic Mass

326.24571

InChI

InChI=1S/C19H34O4/c1-3-4-10-14-17-19(23-17)16(22-2)13-11-8-6-5-7-9-12-15-18(20)21/h11,13,16-17,19H,3-10,12,14-15H2,1-2H3,(H,20,21)/b13-11+

InChIKey

WLOMJJRDPWCKSV-ACCUITESSA-N

SMILES

O1C(C1C(OC)/C=C/CCCCCCCC(O)=O)CCCCC

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	11-methoxy-12,13-epoxy-9-octadecenoic acid (CHEBI:187473) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name

(E)-11-methoxy-11-(3-pentyloxiran-2-yl)undec-9-enoic acid