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Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1CC[C@H]2[C@@H]1[C@@H]1[C@@H](C[C@@H](O)[C@]21C)C(=C)CC(OC(C)=O)C=C(C)C

InChIKey

InChIKey=LUPDHBLMFRBDDB-GAQFUSPISA-N

Formula

C22H34O3

Mass

346.511

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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

Spatane and 4,10-secospatane diterpenoids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Spatane diterpenoid - Cyclic alcohol - Secondary alcohol - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as spatane and 4,10-secospatane diterpenoids. These are diterpenoids with a structure based on the spatane or 4,10-secospatane skeleton. The spatane skeleton is formally derived from a prenylgermacrane by 1,5- and 6,10-cyclisation.

External Descriptors

Not available

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