Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1CC[C@]2(C)[C@H](CCC=C2C)[C@@]1(C)CC\C(C=O)=C\C(O)=O

InChIKey

InChIKey=LUZARHTWSOXFLP-DQLOYZPXSA-N

Formula

C20H30O3

Mass

318.457

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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

Colensane and clerodane diterpenoids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Clerodane diterpenoid - Medium-chain fatty acid - Branched fatty acid - Fatty acyl - Fatty acid - Unsaturated fatty acid - Alpha,beta-unsaturated aldehyde - Enal - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Aldehyde - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as colensane and clerodane diterpenoids. These are diterpenoids with a structure based on the clerodane or the colensane skeleton. Clerodanes arise from labdanes by two methyl migrations.

External Descriptors

Not available

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