Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1CC[C@H]2C(C)(C)C[C@]3(C)CC[C@@H](OC(=O)C(F)(F)F)C123

InChIKey

InChIKey=KMUKQBZVFNTLBW-YVCYQBIISA-N

Formula

C17H25F3O2

Mass

318.38

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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

Angular triquinanes

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Angular triquinane sesquiterpenoid - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organooxygen compound - Organofluoride - Organohalogen compound - Carbonyl group - Alkyl fluoride - Alkyl halide - Hydrocarbon derivative - Organic oxide - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as angular triquinanes. These are triquinane with a structure based on a [6.3.0.0^1,5] undecane carbon skeleton.

External Descriptors

Not available

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