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Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC[C@@]23CC[C@@H]([C@@]2(CC1)OC(=O)CC1=CC=C(Cl)C=C1)C(C)(OC3=O)C=CC=C(C)C(O)=O

InChIKey

InChIKey=NASCNLSRANKCAV-QLVNZVBKSA-N

Formula

C29H31ClO8

Mass

543.01

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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

Not available

Direct Parent

Diterpene lactones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Diterpenoid - Diterpene lactone - Prenyldaucane diterpenoid - Tetracarboxylic acid or derivatives - Caprolactone - Halobenzene - Delta_valerolactone - Delta valerolactone - Chlorobenzene - Oxepane - Monocyclic benzene moiety - Aryl halide - Oxane - Aryl chloride - Benzenoid - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Lactone - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Carboxylic acid - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as diterpene lactones. These are diterpenoids containing a lactone moiety.

External Descriptors

Not available

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