2-(2-phenylethyl)chromone (CHEBI:5092)

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ChEBI Name	2-(2-phenylethyl)chromone

ChEBI ID	CHEBI:5092

Definition	A member of the class of chromones that is chromone which is substituted by a 2-phenylethyl group at position 2. It is found in agarwood, a fragrant resinous heartwood obtained from certain trees in the genus Aquilaria.

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

Supplier Information

Download	Molfile XML SDF

Formula

C17H14O2

Net Charge

Average Mass

250.297

Monoisotopic Mass

250.09938

InChI

InChI=1S/C17H14O2/c18-16-12-14(11-10-13-6-2-1-3-7-13)19-17-9-5-4-8-15(16)17/h1-9,12H,10-11H2

InChIKey

VNZNWFQJBFLELF-UHFFFAOYSA-N

SMILES

C12=C(C(C=C(O1)CCC3=CC=CC=C3)=O)C=CC=C2

Metabolite of Species	Details
Aquilaria sinensis (NCBI:txid210372)	See: PubMed
Aquilaria malaccensis (NCBI:txid223753)	Found in cell suspension culture (BTO:0000221). See: DOI
Imperata cylindrica (NCBI:txid80369)	Found in rhizome (BTO:0001181). See: PubMed

Roles Classification
Biological Role(s):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology
Outgoing	2-(2-phenylethyl)chromone (CHEBI:5092) has functional parent chromone (CHEBI:72013) 2-(2-phenylethyl)chromone (CHEBI:5092) has role plant metabolite (CHEBI:76924) 2-(2-phenylethyl)chromone (CHEBI:5092) is a benzenes (CHEBI:22712) 2-(2-phenylethyl)chromone (CHEBI:5092) is a chromones (CHEBI:23238)

IUPAC Name

2-(2-phenylethyl)-4H-chromen-4-one

Synonyms	Sources
2-(2-phenylethyl)-4H-1-benzopyran-4-one	IUPAC
2-(2-phenylethyl)chromen-4-one	ChEBI
2-(2-phenylethyl)chromone	KEGG COMPOUND
2-phenethylchromone	ChEBI
flidersiachromone	NIST Chemistry WebBook
flindersiachromone	KEGG COMPOUND

Last Modified

12 February 2020