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Structure Information
Structure

Compound Identification

SMILES

CC(=O)N1CC(C(O)C2C=CC3C(N2NC2=C(Cl)C=C(Cl)C=C2)C(=O)NC3=O)C2=CC=CC=C12

InChIKey

InChIKey=WJJUJGOUHXFSBZ-UHFFFAOYSA-N

Formula

C24H22Cl2N4O4

Mass

501.36

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

10,11-secoergolines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

10,11-secoergolines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

10,11-secoergoline - Ergoline skeleton - Alpha-amino acid or derivatives - Indole or derivatives - Pyrrolopyridine - 1,3-dichlorobenzene - Phenylhydrazine - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - 2-pyrrolidone - Pyrrolidone - Pyridine - Pyrrolidine - Dicarboximide - Tertiary carboxylic acid amide - Acetamide - Carboxylic acid imide - Carboxylic acid imide, n-unsubstituted - Carboxamide group - Secondary alcohol - Lactam - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Alkylhydrazine - Organochloride - Organonitrogen compound - Organooxygen compound - Alcohol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Hydrazine derivative - Organohalogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 10,11-secoergolines. These are ergoline derivatives, where carbon atoms C10 and C11 of the ergoline moiety are not linked to each other.

External Descriptors

Not available

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