Structure Information
Structure

Compound Identification

SMILES

[I-].CC[N+](C)(C)CC1C2CC[C@H](C)C3CC[C@@]4(C)O[C@H]4[C@]23OC1=O

InChIKey

InChIKey=AEWMTCNLSOYCDS-OEANGRGVSA-M

Formula

C19H32INO3

Mass

449.373

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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

Cadinanolides

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Cadinanolide skeleton - Sesquiterpenoid - Oxepane - Gamma butyrolactone - Tetraalkylammonium salt - Oxolane - Quaternary ammonium salt - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic iodide salt - Amine - Organic salt - Organic cation - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cadinanolides. These are sesquiterpene lactones based on 2-dioxonaphtho[4a,4-b]furan.

External Descriptors

Not available

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