Structure Information
Structure

Compound Identification

SMILES

CC1CC(=O)C(C(=O)C2=C(COC(=O)C3=CC=C(Br)C=C3)C=CC=C2OCC(C)=C)C(=O)C1(CC=C(C)C)CC=C(C)C

InChIKey

InChIKey=CLGKATSIBMPQIN-UHFFFAOYSA-N

Formula

C36H41BrO6

Mass

649.622

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones - Phenylketones - Alkyl-phenylketones

Direct Parent

Benzoylcyclohexane-1,3-diones

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Benzoylcyclohexane-1,3-dione - Aromatic monoterpenoid - Benzoate ester - Benzyloxycarbonyl - Monocyclic monoterpenoid - Monoterpenoid - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Phenoxy compound - Phenol ether - Aryl alkyl ketone - Benzoyl - 1,3-diketone - Alkyl aryl ether - Bromobenzene - Halobenzene - 1,3-dicarbonyl compound - Monocyclic benzene moiety - Benzenoid - Aryl halide - Aryl bromide - Cyclic ketone - Carboxylic acid ester - Carboxylic acid derivative - Ether - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organobromide - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzoylcyclohexane-1,3-diones. These are alkyl-phenylketones where the alkyl group is a cyclohexane 1,3-dione.

External Descriptors

Not available

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