Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@@]23O[C@@H]2C[C@@]2(C)[C@@H](CC[C@@]22CCC(=O)O2)[C@H]13.CC1=C(N(N=C1C(=O)NN1CCCCC1)C1=C(Cl)C=C(Cl)C=C1)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=POJMHNYAUDLTTJ-PUDZRVQSSA-N

Formula

C46H51Cl3N4O7

Mass

878.29

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Steroid lactones

Intermediate Tree Nodes

Not available

Direct Parent

Spironolactones and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Spironolactone - Phenylpyrazole - Pyrazole-5-carboxamide - 1,3-dichlorobenzene - Halobenzene - Cyclohexenone - Chlorobenzene - Oxepane - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Gamma butyrolactone - Dicarboxylic acid or derivatives - Benzenoid - Piperidine - Azole - Heteroaromatic compound - Oxolane - Methyl ester - Pyrazole - Carboxylic acid hydrazide - Cyclic ketone - Ketone - Lactone - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkyl ether - Oxirane - Ether - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as spironolactones and derivatives. These are steroid lactones with a structure based on the spironolactone skeleton.

External Descriptors

Not available

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