Structure Information
Structure

Compound Identification

SMILES

C[C@]12CC[C@H]3[C@@H](CC=C4C[C@H](CC[C@]34C)OC(=O)C3=CC=C(Cl)C=C3)[C@@H]1CC\C2=N/O

InChIKey

InChIKey=TXUUEGXZHVMHOX-PCZBPSRDSA-N

Formula

C26H32ClNO3

Mass

442.0

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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

Aromatic homopolycyclic compounds

Substituents

Androstane-skeleton - Delta-5-steroid - Benzoate ester - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Chlorobenzene - Halobenzene - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Benzenoid - Carboxylic acid ester - Carboxylic acid derivative - Oxime - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organooxygen compound - Aromatic 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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