5-pentyl-2-furannonanoic acid (CHEBI:230348)

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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	5-pentyl-2-furannonanoic acid

ChEBI ID	CHEBI:230348

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H30O3

Net Charge

Average Mass

294.435

Monoisotopic Mass

294.21949

InChI

InChI=1S/C18H30O3/c1-2-3-8-11-16-14-15-17(21-16)12-9-6-4-5-7-10-13-18(19)20/h14-15H,2-13H2,1H3,(H,19,20)

InChIKey

BJTONYHCPUUWFX-UHFFFAOYSA-N

SMILES

O1C(CCCCCCCCC(O)=O)=CC=C1CCCCC

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). 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	5-pentyl-2-furannonanoic acid (CHEBI:230348) is a heterocyclic fatty acid (CHEBI:48847)

IUPAC Name

9-(5-pentyluran-2-yl)nonanoic acid