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Structure Information
Structure

Compound Identification

SMILES

CC(=O)S[C@H]1CC[C@]2(C)C3CC[C@@]4(C)C(C[C@@H](Br)C4=O)C3[C@@H](O)C=C2C1

InChIKey

InChIKey=GHZVBHQVLRTSCD-IVMSPRINSA-N

Formula

C21H29BrO3S

Mass

441.42

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Androstane steroids

Intermediate Tree Nodes

Not available

Direct Parent

Androstane steroids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Androstane-skeleton - 16-halo-steroid - Halo-steroid - Hydroxysteroid - 17-oxosteroid - Oxosteroid - 7-hydroxysteroid - 7-alpha-hydroxysteroid - Delta-5-steroid - Alpha-haloketone - Secondary alcohol - Carbothioic s-ester - Thiocarboxylic acid ester - Ketone - Thiocarboxylic acid or derivatives - Sulfenyl compound - Carboxylic acid derivative - Organosulfur compound - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - Organobromide - Carbonyl group - Organooxygen compound - Alkyl halide - Alkyl bromide - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as androstane steroids. These are steroids with a structure based on the 19-carbon androstane skeleton.

External Descriptors

Not available

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