Structure Information
Structure

Compound Identification

SMILES

C\C=C(/C)[C@H]1[C@@H](\C=C\C=C(/C)[C@@H](OC(=O)C2=CC=C(Br)C=C2)[C@@H](C)COC(=O)C(C)(C)C)[C@@H]2C[C@@H]3O[C@]3(C)C[C@H]2[C@@H]2O[C@]12C

InChIKey

InChIKey=YRLQMFJIGSBMPT-CDBUXSLOSA-N

Formula

C37H49BrO6

Mass

669.697

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Benzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoate ester - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoyl - Bromobenzene - Halobenzene - Oxepane - Aryl halide - Aryl bromide - Carboxylic acid ester - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Organic oxide - Organobromide - Carbonyl group - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.

External Descriptors

Not available

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