3,7-dimethylocta-2,6-dienoate(1-) (CHEBI:142930)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	3,7-dimethylocta-2,6-dienoate(1−)

ChEBI ID	CHEBI:142930

ChEBI ASCII Name	3,7-dimethylocta-2,6-dienoate(1-)

Definition	Major species at pH 7.3.

Stars	This entity has been manually annotated by a third party.

Submitter	Anne Morgat

Supplier Information	No supplier information found for this compound.

Download	Molfile XML SDF

Formula

C10H15O2

Net Charge

-1

Average Mass

167.229

Monoisotopic Mass

167.10775

InChI

InChI=1S/C10H16O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,7H,4,6H2,1-3H3,(H,11,12)/p-1

InChIKey

ZHYZQXUYZJNEHD-UHFFFAOYSA-M

SMILES

C(C(=CC(=O)[O-])C)CC=C(C)C

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	3,7-dimethylocta-2,6-dienoate(1−) (CHEBI:142930) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020) 3,7-dimethylocta-2,6-dienoate(1−) (CHEBI:142930) is a methyl-branched fatty acid (CHEBI:62499) 3,7-dimethylocta-2,6-dienoate(1−) (CHEBI:142930) is a monoterpenoid (CHEBI:25409) 3,7-dimethylocta-2,6-dienoate(1−) (CHEBI:142930) is a polyunsaturated fatty acid anion (CHEBI:76567)

Synonym	Source
3,7-dimethylocta-2,6-dienoate	UniProt

Last Modified

02 July 2019