Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C([C@H]2C(=O)[C@@H]1[C@]13[C@H]4C[C@H](C=C4)[C@]21C(=O)C(Br)=C(Br)C3=O)C(=O)OC

InChIKey

InChIKey=OVWXOFVHCFEATL-JBUVXQFPSA-N

Formula

C20H14Br2O7

Mass

526.133

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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 - Cyclic ketones

Direct Parent

Cyclohexenones

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Cyclohexenone - Dicarboxylic acid or derivatives - Alpha-haloketone - Methyl ester - Enoate ester - Vinylogous halide - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Carboxylic acid derivative - Vinyl bromide - Vinyl halide - Bromoalkene - Haloalkene - Organobromide - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as cyclohexenones. These are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond.

External Descriptors

Not available

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