Structure Information
Structure

Compound Identification

SMILES

CC(C)OC(=O)[C@@H]1C(O)C2=CC(=O)CCC2(C)C2CCC3(C)C(CC[C@@]33CCC(=O)O3)C12

InChIKey

InChIKey=SQDXDCFKVDANPZ-FMAINMQASA-N

Formula

C26H36O6

Mass

444.568

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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 - 3-oxo-delta-4-steroid - 3-oxosteroid - 6-hydroxysteroid - Oxosteroid - Hydroxysteroid - Delta-4-steroid - Cyclohexenone - Beta-hydroxy acid - Dicarboxylic acid or derivatives - Gamma butyrolactone - Hydroxy acid - Cyclic alcohol - Tetrahydrofuran - Secondary alcohol - Cyclic ketone - Carboxylic acid ester - Ketone - Lactone - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Alcohol - 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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