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Structure Information
Structure

Compound Identification

SMILES

CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)[C@@H]5C[C@@H]5[C@]4(C)[C@H]3CC[C@]12C

InChIKey

InChIKey=DUSHUSLJJMDGTE-ZJPMUUANSA-N

Formula

C22H27ClO3

Mass

374.91

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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 - 20-oxosteroid - 3-oxosteroid - 6-halo-steroid - Halo-steroid - Hydroxysteroid - Oxosteroid - 17-hydroxysteroid - Cyclohexenone - Cyclic alcohol - Alpha-hydroxy ketone - Tertiary alcohol - Ketone - Vinyl halide - Vinyl chloride - Haloalkene - Chloroalkene - Organooxygen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Alcohol - Organic oxygen compound - Organic oxide - Carbonyl group - 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

CHEBI:50742 : 17alpha-hydroxy steroid - 3-oxo Delta(4)-steroid - 20-oxo steroid - chlorinated steroid

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