Structure Information
Structure

Compound Identification

SMILES

CC(=O)O[C@H]1CC(=C)[C@]2(CCC(C)=C(Cl)C2)C(C)(C)[C@@H]1Br

InChIKey

InChIKey=GQCHYEJJCOTYBA-ZMSDIMECSA-N

Formula

C17H24BrClO2

Mass

375.73

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Sesquiterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Chamigranes

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Chamigrane sesquiterpenoid - Carboxylic acid ester - Chloroalkene - Haloalkene - Vinyl halide - Vinyl chloride - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organobromide - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl bromide - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as chamigranes. These are sesquiterpenoids characterized by a 1,1,5,9-tetramethylspiro[5,5]undecane skeleton, formally obtained by linking the C1-C6 and C6-C11 of farnesane together. They are predominantly isolated from algae.

External Descriptors

Not available

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