Structure Information
Structure

Compound Identification

SMILES

FC1C(F)(C2CCCCC2)C(F)(C2CCCCC2)C(F)(C2CCCCC2)C(OC2=CC=CC=C2)(C2CCCCC2)C1(C1CCCCC1)C1=C(F)C(F)=C(F)C=C1

InChIKey

InChIKey=XXOYFNPPSSZDGJ-UHFFFAOYSA-N

Formula

C48H63F7O

Mass

789.02

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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

Elemane sesquiterpenoids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Elemane sesquiterpenoid - Phenoxy compound - Phenol ether - Cyclohexyl halide - Halobenzene - Fluorobenzene - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Fluoroalkene - Haloalkene - Vinyl halide - Vinyl fluoride - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as elemane sesquiterpenoids. These are sesquiterpenoids with a structure based on the elemane skeleton. Elemane is a monocyclic compound consisting of a cyclohexane ring substituted with a methyl group, an ethyl group, and two 1-methylethyl groups at the 1-, 1-, 2-, and 4-position, respectively.

External Descriptors

Not available

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