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Structure Information
Structure

Compound Identification

SMILES

COC(=O)C=C1CCC2C3CCC4=CC(=O)C(Br)CC4(C)C3C(=O)CC12C

InChIKey

InChIKey=VGARIQOMXRAOII-UHFFFAOYSA-N

Formula

C22H27BrO4

Mass

435.358

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Pregnane steroids

Intermediate Tree Nodes

Not available

Direct Parent

Gluco/mineralocorticoids, progestogins and derivatives

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Progestogin-skeleton - 3-oxo-delta-4-steroid - 3-oxosteroid - Oxosteroid - 11-oxosteroid - 2-halo-steroid - Halo-steroid - Delta-4-steroid - Cyclohexenone - Alpha-haloketone - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carboxylic acid ester - Cyclic ketone - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organobromide - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Alkyl halide - Alkyl bromide - Organohalogen compound - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as gluco/mineralocorticoids, progestogins and derivatives. These are steroids with a structure based on a hydroxylated prostane moiety.

External Descriptors

Not available

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