Structure Information
Structure

Compound Identification

SMILES

COC1=C(CBr)C=C2[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CCC2=C1CBr

InChIKey

InChIKey=MIRBCRXKIBUCFR-POXQLVPFSA-N

Formula

C21H26Br2O2

Mass

470.245

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Estrane steroids

Intermediate Tree Nodes

Not available

Direct Parent

Estrane steroids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Oxosteroid - 17-oxosteroid - Estrane-skeleton - Phenanthrene - Tetralin - Anisole - Alkyl aryl ether - Benzenoid - Ketone - Ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl bromide - Aromatic homopolycyclic compound

Description

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

External Descriptors

Not available

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