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Structure Information
Structure

Compound Identification

SMILES

CC(CC(=O)C=C(C)C)[C@H]1CC[C@]2(C)[C@@H]1CCC(C)=CC2=O

InChIKey

InChIKey=CMHJRVRWFDDFCR-YEDOYLKBSA-N

Formula

C20H30O2

Mass

302.458

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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

Sphenolobane diterpenoids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Prenyldaucane diterpenoid - Alpha,beta-unsaturated ketone - Enone - Acryloyl-group - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as sphenolobane diterpenoids. These are diterpenoids with a structure characterized by a sphenolobane skeleton. They possess a trans-fused hydroazulenoid skeleton as a common structural motif, but differ in configuration at C(9), where a prenyl group is attached. Sphenolobane is also considered an 'extended' daucane skeleton, with a carbon side chain appended onto the cyclopentane ring.

External Descriptors

Not available

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