Structure Information
Structure

Compound Identification

SMILES

Cl.C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](CCN(CCCN)CCCCN)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4

InChIKey

InChIKey=VWTDCHZFKGNYKZ-UTFJDJNESA-N

Formula

C24H46ClN3O4

Mass

476.1

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Sesquiterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Artemisinins

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Artemisinin skeleton - Oxepane - Oxane - 1,2,4-trioxane - Tertiary amine - Tertiary aliphatic amine - Dialkyl peroxide - Organoheterocyclic compound - Acetal - Oxacycle - Hydrocarbon derivative - Primary amine - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic nitrogen compound - Hydrochloride - Amine - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as artemisinins. These are sesquiterpenoids originally isolated from the herb Artemisia annua. Their structure is based on artemisinin, a tetracyclic compound that contains a 1,2-dioxepane fused to an octahydrobenzopyran moiety. The internal peroxide bridge is believed to be a key to the mode of action of artemisinins.

External Descriptors

Not available

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