Structure Information
Structure

Compound Identification

SMILES

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

InChIKey

InChIKey=KEHQDJGFPAZFGS-BIVQUFGESA-N

Formula

C15H22O9S2

Mass

410.45

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Terpene lactones

Intermediate Tree Nodes

Sesquiterpene lactones

Direct Parent

Ambrosanolides and secoambrosanolides

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Ambrosanolide - Pseudoguaiane sesquiterpenoid - Sesquiterpenoid - Gamma butyrolactone - Oxolane - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Lactone - Ketone - Carboxylic acid ester - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as ambrosanolides and secoambrosanolides. These are sesquiterpene lactones from the Ambrosia family, with a backbone derivative of azuleno[6,5-b]furan-2-one (ambrosanolides) or azuleno[4,5-b]furan-2-one (secoambrosanolides).

External Descriptors

Not available

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