nerol oxide (CHEBI:144705)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	nerol oxide

ChEBI ID	CHEBI:144705

Definition	A member of the class of pyrans that is 3,6-dihydro-2H-pyran which is substituted at positions 2 and 4 by a 2-methylprop-1-en-1-yl group and a methyl group, respectively.

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

Submitter	Mark Williams

Supplier Information

Download	Molfile XML SDF

Formula

C10H16O

Net Charge

Average Mass

152.237

Monoisotopic Mass

152.12012

InChI

InChI=1S/C10H16O/c1-8(2)6-10-7-9(3)4-5-11-10/h4,6,10H,5,7H2,1-3H3

InChIKey

FRISMOQHTLZZRP-UHFFFAOYSA-N

SMILES

O1C(CC(=CC1)C)C=C(C)C

Metabolite of Species	Details
Vitis vinifera (NCBI:txid29760)	Found in berry (BTO:0000119). of strain Vitis vinifera L. cv. Italia See: MetaboLights Study
Vitis vinifera (NCBI:txid29760)	Found in berry (BTO:0000119). of strain Vitis vinifera L. cv. Zaomeiguixiang See: MetaboLights Study
Vitis vinifera (NCBI:txid29760)	Found in berry (BTO:0000119). of strain Vitis vinifera L. cv. Xiangfei See: MetaboLights Study
Euroleon nostras (NCBI:txid516507)	Found in gland (BTO:0000522). Detected in the thoracic gland. 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. flavouring agent A food additive that is used to added improve the taste or odour of a food. animal metabolite Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.

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

ChEBI Ontology
Outgoing	nerol oxide (CHEBI:144705) has functional parent nerol (CHEBI:29452) nerol oxide (CHEBI:144705) has role animal metabolite (CHEBI:75767) nerol oxide (CHEBI:144705) has role flavouring agent (CHEBI:35617) nerol oxide (CHEBI:144705) has role plant metabolite (CHEBI:76924) nerol oxide (CHEBI:144705) is a monoterpenoid (CHEBI:25409) nerol oxide (CHEBI:144705) is a olefinic compound (CHEBI:78840) nerol oxide (CHEBI:144705) is a pyrans (CHEBI:26407)

IUPAC Name

4-methyl-2-(2-methylprop-1-en-1-yl)-3,6-dihydro-2H-pyran

Synonyms	Sources
3,6-dihydro-4-methyl-2-(2-methyl-1-propenyl)-2H-pyran	ChemIDplus
3,6-dihydro-4-methyl-2-(2-methylpropen-1-yl)-2H-pyran	ChemIDplus
3,6-dihydro-4-methyl-2-(2-methylpropenyl)-2H-pyran	ChemIDplus
4-methyl-2-(2-methyl-1-propen-1-yl)-3,6-dihydro-2H-pyran	ChEBI
4-methyl-2-(2-methylprop-1-enyl)-3,6-dihydro-2H-pyran	ChEBI
neryl oxide	NIST Chemistry WebBook

Last Modified

03 October 2019