Structure Information
Structure

Compound Identification

SMILES

CO[C@](C(=O)O[C@H]1CC\C(C)=C\CC\C(C)=C\[C@@H]2OC(=O)C(=C)[C@@H]2CC[C@@]1(C)O)(C1=CC=CC=C1)C(F)(F)F

InChIKey

InChIKey=JMPONPHSVQFOJR-UEBFRSACSA-N

Formula

C30H37F3O6

Mass

550.615

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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

Diterpene lactones

Direct Parent

Cembranolides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cembranolide-skeleton - Cembrane diterpenoid - Diterpenoid - Benzylether - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Gamma butyrolactone - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Oxolane - Tertiary alcohol - Lactone - Carboxylic acid ester - Carboxylic acid derivative - Ether - Oxacycle - Organoheterocyclic compound - Dialkyl ether - Alkyl halide - Alcohol - Hydrocarbon derivative - Alkyl fluoride - Organohalogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organofluoride - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cembranolides. These are diterpenoids with a structure based on a cembrane skeleton fused to a lactone ring (5- or 6-membered).

External Descriptors

Not available

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