1,8-cineole (CHEBI:27961)

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ChEBI Name	1,8-cineole

ChEBI ID	CHEBI:27961

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

Secondary ChEBI IDs	CHEBI:35814, CHEBI:41535, CHEBI:561, CHEBI:18956, CHEBI:23242

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Formula

C10H18O

Net Charge

Average Mass

154.24932

Monoisotopic Mass

154.13577

InChI

InChI=1S/C10H18O/c1-9(2)8-4-6-10(3,11-9)7-5-8/h8H,4-7H2,1-3H3/t8-,10+

InChIKey

WEEGYLXZBRQIMU-WAAGHKOSSA-N

SMILES

C[C@@]12CC[C@@H](CC1)C(C)(C)O2

Metabolite of Species	Details
Melaleuca alternifolia (NCBI:txid164405)	Found in leaf (BTO:0000713). See: PubMed

Roles Classification
Biological Role(s):	flavouring agent A food additive that is used to added improve the taste or odour of a food. volatile oil component Any plant metabolite that is found naturally as a component of a volatile oil. (via cineole )

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

ChEBI Ontology
Outgoing	1,8-cineole (CHEBI:27961) has role flavouring agent (CHEBI:35617) 1,8-cineole (CHEBI:27961) is a cineole (CHEBI:23243)

Incoming	tea tree oil (CHEBI:83629) has part 1,8-cineole (CHEBI:27961)

IUPAC Name

1,3,3-trimethyl-2-oxabicyclo[2.2.2]octane

Synonyms	Sources
1,3,3-TRIMETHYL-2-OXABICYCLO[2.2.2]OCTANE	PDBeChem
1,8-Cineol	KEGG COMPOUND
1,8-Cineole	KEGG COMPOUND
1,8-cineole	UniProt
1,8-cineole	IUBMB
1,8-epoxy-p-menthane	ChemIDplus
1,8-oxido-p-menthane	NIST Chemistry WebBook
cajeputol	ChemIDplus
cineole	ChemIDplus
eucalyptol	ChemIDplus
Zineol	NIST Chemistry WebBook

Last Modified

23 October 2015