Structure Information
Structure

Compound Identification

SMILES

CC(=O)OCC(=O)C1=CC[C@H]2[C@@H]3C[C@@H](F)C4=CC(=O)C(Br)=C[C@]4(C)C3=CC[C@]12C

InChIKey

InChIKey=XKZWOGXOACFWQZ-CKCVXRQJSA-N

Formula

C23H24BrFO4

Mass

463.343

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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-oxo-delta-1,4-steroid - 3-oxosteroid - 2-halo-steroid - 6-halo-steroid - Oxosteroid - Halo-steroid - Delta-1,4-steroid - Alpha-acyloxy ketone - Alpha-haloketone - Carboxylic acid ester - Cyclic ketone - Ketone - Carboxylic acid derivative - Bromoalkene - Haloalkene - Vinyl halide - Vinyl bromide - Monocarboxylic acid or derivatives - Alkyl fluoride - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Alkyl halide - Organooxygen compound - Organofluoride - Carbonyl group - Organohalogen compound - Organobromide - 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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