3-Methyl-5-pentyl-2-furanpentanoic acid (CHEBI:191627)

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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	3-Methyl-5-pentyl-2-furanpentanoic acid

ChEBI ID	CHEBI:191627

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H24O3

Net Charge

Average Mass

252.354

Monoisotopic Mass

252.17254

InChI

InChI=1S/C15H24O3/c1-3-4-5-8-13-11-12(2)14(18-13)9-6-7-10-15(16)17/h11H,3-10H2,1-2H3,(H,16,17)

InChIKey

OVQQXXHYNCJQNP-UHFFFAOYSA-N

SMILES

O1C(CCCCC(O)=O)=C(C=C1CCCCC)C

Metabolite of Species	Details
Solanum tuberosum (NCBI:txid4113)	Found in leaf (BTO:0000713). 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	3-Methyl-5-pentyl-2-furanpentanoic acid (CHEBI:191627) is a heterocyclic fatty acid (CHEBI:48847)

IUPAC Name

5-(3-methyl-5-pentyluran-2-yl)pentanoic acid