Structure Information
Structure

Compound Identification

SMILES

CCCCCCCCCCOC(=O)CCC\C=C/[C@@H]1[C@H]2CC[C@H](C2)[C@H]1CNS(=O)(=O)C1=CC=C(Br)C=C1

InChIKey

InChIKey=KLMMNRLRCVRTDN-IVMBPFMGSA-N

Formula

C30H46BrNO4S

Mass

596.67

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Fatty acid esters

Intermediate Tree Nodes

Wax esters

Direct Parent

Wax monoesters

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Wax monoester skeleton - Aromatic monoterpenoid - Monoterpenoid - Bicyclic monoterpenoid - Benzenesulfonamide - Norbornane monoterpenoid - Benzenesulfonyl group - Halobenzene - Bromobenzene - Organosulfonic acid amide - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Benzenoid - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organobromide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as wax monoesters. These are waxes bearing an ester group at exactly one position.

External Descriptors

Not available

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