Structure Information
Structure

Compound Identification

SMILES

C\C1=C/CC\C(C)=C\[C@@H]2OC(=O)C(=C)[C@@H]2CC[C@@](C)(O)[C@@H](O)CC1

InChIKey

InChIKey=WDYIJCIIHZASEC-GPLSHMABSA-N

Formula

C20H30O4

Mass

334.456

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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

Aliphatic heteropolycyclic compounds

Substituents

Cembranolide-skeleton - Cembrane diterpenoid - Diterpenoid - Gamma butyrolactone - Oxolane - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tertiary alcohol - 1,2-diol - Carboxylic acid ester - Lactone - Secondary alcohol - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - Organooxygen compound - Carbonyl group - Aliphatic 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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