Structure Information
Structure

Compound Identification

SMILES

[Cl-].COC1=C(OC)C=C2C[NH+](CC3[C@H]4[C@@H]5O[C@@]55[C@@H](C)CCC[C@]5(C)C[C@H]4OC3=O)CCC2=C1

InChIKey

InChIKey=XELSJJOHXKKJDR-JMRIYMDTSA-N

Formula

C26H36ClNO5

Mass

478.03

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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

Eudesmanolides, secoeudesmanolides, and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Eudesmanolide - Sesquiterpenoid - Naphthofuran - Tetrahydroisoquinoline - Anisole - Phenol ether - Alkyl aryl ether - Aralkylamine - Oxepane - Gamma butyrolactone - Benzenoid - Oxolane - Quaternary ammonium salt - Carboxylic acid ester - Lactone - Tertiary aliphatic amine - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organic chloride salt - Organonitrogen compound - Organooxygen compound - Amine - Organic salt - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as eudesmanolides, secoeudesmanolides, and derivatives. These are terpenoids with a structure based on the eudesmanolide (a 3,5a,9-trimethyl-naphtho[1,2-b]furan-2-one derivative) or secoeudesmanolide (a 3,6-dimethyl-5-(pentan-2-yl)-1-benzofuran-2-one derivative) skeleton.

External Descriptors

Not available

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