Structure Information
Structure

Compound Identification

SMILES

CC(=O)OCC12C(O)CCC(C)(C)[C@H]1CC(O)[C@@]13[C@H](O)[C@@H](CC[C@@H]21)C(=C)C3=O

InChIKey

InChIKey=FWBSIMCZPHJUNZ-UQFRWTFDSA-N

Formula

C22H32O6

Mass

392.492

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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

Kaurane diterpenoids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Kaurane diterpenoid - Fatty alcohol ester - B'-hydroxy-alpha,beta-unsaturated-ketone - Alpha-branched alpha,beta-unsaturated-ketone - Beta-hydroxy ketone - Alpha,beta-unsaturated ketone - Enone - Cyclic alcohol - Acryloyl-group - Secondary alcohol - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as kaurane diterpenoids. These are diterpene alkaloids with a structure that is based on the kaurane skeleton. Kaurane is a tetracyclic compound that arises by cyclisation of a pimarane precursor followed by rearrangement. It possesses a [3,2,1]-bicyclic ring system with C15-C16 bridge connected to C13, forming the five-membered ring D.

External Descriptors

Not available

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