Structure Information
Structure

Compound Identification

SMILES

CC(=O)C1=CC=C(NC(=O)[C@H]2[C@@H]3C[C@H]4[C@H](OC(=O)[C@@H]24)[C@@H]3Cl)C=C1

InChIKey

InChIKey=DQJUCISXZNZOJS-QAIIKZMUSA-N

Formula

C17H16ClNO4

Mass

333.77

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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

Not available

Direct Parent

Terpene lactones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Terpene lactone - Alkyl-phenylketone - Monoterpenoid - Aromatic monoterpenoid - Norbornane monoterpenoid - Acetophenone - Anilide - Phenylketone - Aryl alkyl ketone - Aryl ketone - N-arylamide - Caprolactone - Benzoyl - Oxepane - Gamma butyrolactone - Benzenoid - Monocyclic benzene moiety - Oxolane - Carboxamide group - Carboxylic acid ester - Ketone - Lactone - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Alkyl halide - Alkyl chloride - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as terpene lactones. These are prenol lipids containing a lactone ring.

External Descriptors

Not available

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