Structure Information
Structure

Compound Identification

SMILES

CCCCC1=CC(=O)C[C@@]2(C)CC[C@@H]3CC12OC3(C)C

InChIKey

InChIKey=RQTJOLQTJAXFIA-OMOCGIRRSA-N

Formula

C18H28O2

Mass

276.42

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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

Agarofurans

Alternative Parents

Oxepanes Cyclohexenones Oxolanes Oxacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Agarofuran - Cyclohexenone - Oxepane - Oxolane - Ketone - Cyclic ketone - Dialkyl ether - Ether - Oxacycle - Organoheterocyclic compound - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as agarofurans. These are organic compounds containing an agarofuran moiety( a three-ring system, with core fragment oxatricyclo[7.2.1.0^{1,6}]dodec-2-ene).

External Descriptors

Not available

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