Structure Information
Structure

Compound Identification

SMILES

C[C@]12C[C@H]3O[C@@]33[C@@H]([C@H]4C[C@H]4C4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@@]21CCC(=O)O1

InChIKey

InChIKey=BFKIVGKTVYUAMU-ZIJBBKHZSA-N

Formula

C23H26O4

Mass

366.457

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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

Aliphatic heteropolycyclic compounds

Substituents

Spironolactone - Oxepane - Gamma butyrolactone - Oxolane - Carboxylic acid ester - Ketone - Lactone - Cyclic ketone - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Oxacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organic oxygen compound - Aliphatic 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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