Structure Information
Structure

Compound Identification

SMILES

C\C1=C/CC[C@](C)(Cl)[C@@H](O)C[C@@H]2[C@H](C\C(C)=C\CC1)OC(=O)C2=C

InChIKey

InChIKey=DURMYJZHFPZWOI-SGXOOQGTSA-N

Formula

C20H29ClO3

Mass

352.9

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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 - Carboxylic acid ester - Chlorohydrin - Halohydrin - Lactone - Secondary alcohol - Monocarboxylic acid or derivatives - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Alkyl halide - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - Organohalogen compound - Organochloride - 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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