Structure Information
Structure

Compound Identification

SMILES

CCCCC[C@H]1[C@@H](CC([O-])=O)CC(=CC2=CC=C(Br)C=C2)C1=O

InChIKey

InChIKey=ITQIFTCSKNMRIM-PBHICJAKSA-M

Formula

C19H22BrO3

Mass

378.287

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Lineolic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Jasmonic acids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Jasmonic acid - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Carboxylic acid salt - Cyclic ketone - Ketone - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxide - Organooxygen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organic anion - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as jasmonic acids. These are lipids containing or derived from a jasmonic acid, with a structure characterized by the presence of an alkene chain linked to a 2-(3-oxocyclopentyl)acetic acid moiety.

External Descriptors

Not available

Previous Back Next