Structure Information
Structure

Compound Identification

SMILES

CCC(C)C(=O)OC1CC(=O)C2(C)CC3C(CC(C)C12)OC(=O)C3(O)CO

InChIKey

InChIKey=SMAJXKLVHWNBRU-UHFFFAOYSA-N

Formula

C20H30O7

Mass

382.453

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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 - Sesquiterpenoid - Pseudoguaiane sesquiterpenoid - Fatty acid ester - Dicarboxylic acid or derivatives - Fatty acyl - Gamma butyrolactone - Tertiary alcohol - Oxolane - 1,2-diol - Carboxylic acid ester - Ketone - Lactone - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Primary alcohol - Organooxygen compound - 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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