1-penten-3-one (CHEBI:89945)

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ChEBI Name	1-penten-3-one

ChEBI ID	CHEBI:89945

Definition	An enone that is pent-1-ene substituted by an oxo group at position 3.

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

Supplier Information

Download	Molfile XML SDF

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Formula

C5H8O

Net Charge

Average Mass

84.118

Monoisotopic Mass

84.05751

InChI

InChI=1S/C5H8O/c1-3-5(6)4-2/h3H,1,4H2,2H3

InChIKey

JLIDVCMBCGBIEY-UHFFFAOYSA-N

SMILES

CCC(=O)C=C

Metabolite of Species	Details
Olea europaea (NCBI:txid4146)	See: PubMed
Homo sapiens (NCBI:txid9606)	Found in saliva (UBERON:0001836). See: PubMed
Homo sapiens (NCBI:txid9606)	Found in faeces (UBERON:0001988). See: PubMed

Roles Classification
Biological Role(s):	human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). flavouring agent A food additive that is used to added improve the taste or odour of a food. plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. genotoxin A role played by a chemical compound to induce direct or indirect DNA damage. Such damage can potentially lead to the formation of a malignant tumour, but DNA damage does not lead inevitably to the creation of cancerous cells.

Application(s):	flavouring agent A food additive that is used to added improve the taste or odour of a food.

ChEBI Ontology
Outgoing	1-penten-3-one (CHEBI:89945) has role flavouring agent (CHEBI:35617) 1-penten-3-one (CHEBI:89945) has role genotoxin (CHEBI:50902) 1-penten-3-one (CHEBI:89945) has role human metabolite (CHEBI:77746) 1-penten-3-one (CHEBI:89945) has role plant metabolite (CHEBI:76924) 1-penten-3-one (CHEBI:89945) is a enone (CHEBI:51689)

IUPAC Name

pent-1-en-3-one

Last Modified

05 November 2021