geranyl benzoate (CHEBI:156234)

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ChEBI Name	geranyl benzoate

ChEBI ID	CHEBI:156234

Definition	A benzoate ester resulting from the formal condensation of the carboxy group of benzoic acid with the hydroxy group of geraniol.

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

Submitter	Anne Morgat

Supplier Information

Download	Molfile XML SDF

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Formula

C17H22O2

Net Charge

Average Mass

258.361

Monoisotopic Mass

258.16198

InChI

InChI=1S/C17H22O2/c1-14(2)8-7-9-15(3)12-13-19-17(18)16-10-5-4-6-11-16/h4-6,8,10-12H,7,9,13H2,1-3H3/b15-12+

InChIKey

YDVXYTIIPGKIJP-NTCAYCPXSA-N

SMILES

C(\CCC=C(C)C)(=C/COC(C=1C=CC=CC1)=O)/C

Metabolite of Species	Details
Gardenia taitensis (NCBI:txid83587)	See: DOI

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.

Application(s):	fragrance A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell.

ChEBI Ontology
Outgoing	geranyl benzoate (CHEBI:156234) has functional parent benzoic acid (CHEBI:30746) geranyl benzoate (CHEBI:156234) has functional parent geraniol (CHEBI:17447) geranyl benzoate (CHEBI:156234) has role fragrance (CHEBI:48318) geranyl benzoate (CHEBI:156234) has role plant metabolite (CHEBI:76924) geranyl benzoate (CHEBI:156234) is a benzoate ester (CHEBI:36054) geranyl benzoate (CHEBI:156234) is a monoterpenoid (CHEBI:25409) geranyl benzoate (CHEBI:156234) is a olefinic compound (CHEBI:78840)

IUPAC Name

(2E)-3,7-dimethylocta-2,6-dien-1-yl benzoate

Synonyms	Sources
(2E)-geranyl benzoate	UniProt
benzoic acid geraniol ester	ChemIDplus
benzoic acid geranyl ester	ChemIDplus
benzoic acid, geraniol ester	ChemIDplus
geraniol benzoate	ChemIDplus
trans-3,7-dimethyl-2,6-octadien-1-yl benzoate	ChemIDplus

Last Modified

28 October 2020