2-pentylfuran (CHEBI:89197)

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ChEBI Name	2-pentylfuran

ChEBI ID	CHEBI:89197

Definition	A member of the class of furans that is furan in which the hydrogen at position 2 is replaced by a pentyl group. It is found in many heat-processed foods and drinks.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C9H14O

Net Charge

Average Mass

138.210

Monoisotopic Mass

138.10447

InChI

InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3

InChIKey

YVBAUDVGOFCUSG-UHFFFAOYSA-N

SMILES

CCCCCC1=CC=CO1

Metabolite of Species	Details
Bacillus megaterium (NCBI:txid1404)	of strain XTBG34 See: PubMed
Albizia lebbeck (NCBI:txid371650)	See: PubMed
Trichoderma asperelloides (NCBI:txid702382)	See: PubMed
Aspergillus fumigatus (NCBI:txid746128)	See: PubMed
Homo sapiens (NCBI:txid9606)	Found in urine (BTO:0001419). See: Zhang, S., Liu, L., Steffen, D., Ye, T., Raftery, D. (2012) Metabolic profiling of gender: Headspace-SPME/GC–MS and 1H NMR analysis of urine. Metabolomics 8:323–334.
Homo sapiens (NCBI:txid9606)	Found in faeces (UBERON:0001988). See: PubMed
Homo sapiens (NCBI:txid9606)	Found in saliva (UBERON:0001836). See: PubMed

Roles Classification
Biological Role(s):	Aspergillus metabolite Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus . human urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples. volatile oil component Any plant metabolite that is found naturally as a component of a volatile oil. flavouring agent A food additive that is used to added improve the taste or odour of a food. plant growth stimulator bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria.

Application(s):	insect repellent An insecticide that acts as a repellent to insects. flavouring agent A food additive that is used to added improve the taste or odour of a food.

ChEBI Ontology
Outgoing	2-pentylfuran (CHEBI:89197) has role Aspergillus metabolite (CHEBI:76956) 2-pentylfuran (CHEBI:89197) has role bacterial metabolite (CHEBI:76969) 2-pentylfuran (CHEBI:89197) has role flavouring agent (CHEBI:35617) 2-pentylfuran (CHEBI:89197) has role human urinary metabolite (CHEBI:84087) 2-pentylfuran (CHEBI:89197) has role insect repellent (CHEBI:71692) 2-pentylfuran (CHEBI:89197) has role plant growth stimulator (CHEBI:26157) 2-pentylfuran (CHEBI:89197) has role volatile oil component (CHEBI:27311) 2-pentylfuran (CHEBI:89197) is a furans (CHEBI:24129)

IUPAC Name

2-pentylfuran

Last Modified

18 June 2021