Structure Information
Structure

Compound Identification

SMILES

C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4Br)[C@@H]1C[C@H](Br)C2=O

InChIKey

InChIKey=WALNGSHUZXVAOU-MOITUIEZSA-N

Formula

C18H20Br2O2

Mass

428.164

Export to:

JSON SDF CSV

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

Estrogens and derivatives

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Estrogen-skeleton - 3-hydroxysteroid - 16-halo-steroid - 4-halo-steroid - Halo-steroid - Hydroxysteroid - 17-oxosteroid - Oxosteroid - Phenanthrene - Tetralin - 2-halophenol - 2-bromophenol - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Aryl bromide - Aryl halide - Benzenoid - Alpha-haloketone - Ketone - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Carbonyl group - Organooxygen compound - Organobromide - Alkyl halide - Alkyl bromide - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as estrogens and derivatives. These are steroids with a structure containing a 3-hydroxylated estrane.

External Descriptors

Not available

Previous Back Next