Structure Information
Structure

Compound Identification

SMILES

CO[C@@](C(=O)O[C@@H]1C(=C)CC[C@H]2[C@H](C)CC[C@H]3[C@@H](C)C(=O)O[C@@]123)(C1=CC=CC=C1)C(F)(F)F

InChIKey

InChIKey=LKUSVRAANIFUEL-OMIGKNLDSA-N

Formula

C25H29F3O5

Mass

466.497

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Terpene lactones

Intermediate Tree Nodes

Sesquiterpene lactones

Direct Parent

Cadinanolides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cadinanolide skeleton - Sesquiterpenoid - Cadinane sesquiterpenoid - Naphthofuran - Benzylether - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Gamma butyrolactone - Benzenoid - Oxolane - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Ether - Oxacycle - Dialkyl ether - Carboxylic acid derivative - Organooxygen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organofluoride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cadinanolides. These are sesquiterpene lactones based on 2-dioxonaphtho[4a,4-b]furan.

External Descriptors

Not available

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