Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC(=O)C=C(C)CCC=C(C)C(=O)C[C@@H](C(C)C)C(=O)C1

InChIKey

InChIKey=IJADVOYKPSKJHT-SFHVURJKSA-N

Formula

C21H28O5

Mass

360.45

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Diterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Cembrane diterpenoids

Alternative Parents

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

Cembrane diterpenoid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Cyclic ketone - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as cembrane diterpenoids. These are diterpenoids with a structure based a cembrane skeleton, which is characterized by the presence of an isopropyl group at C-1 and by three symmetrically disposed methyl groups a the t C-4, -8 and -12 positions.

External Descriptors

Not available

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