Structure Information
Structure

Compound Identification

SMILES

BrC12C3C4C5C6C3C3C7C6C6C5C5C4C1C1C(C23)C7C6(Br)C51

InChIKey

InChIKey=JTPPAJQWCSADGD-UHFFFAOYSA-N

Formula

C20H18Br2

Mass

418.172

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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

Triquinane sesquiterpenoids

Direct Parent

Linear triquinanes

Alternative Parents

Organobromides Hydrocarbon derivatives Alkyl bromides

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Linear triquinane sesquiterpenoid - Hydrocarbon derivative - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as linear triquinanes. These are triquinane with a structure based on a [6.3.0.0^2,6] undecane carbon skeleton.

External Descriptors

Not available

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