Structure Information
Structure

Compound Identification

SMILES

C[C@]1(O)CC[C@H]2[C@@H]3CC=C4C5(CC5)C(=O)[C@@H](C[C@]4(C)[C@H]3CC[C@]12C)C#N

InChIKey

InChIKey=DKJRYSHVLUXLSD-YSFZIFSESA-N

Formula

C23H31NO2

Mass

353.506

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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

Estrogens and derivatives

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Estrogen-skeleton - 17-hydroxysteroid - Oxosteroid - Hydroxysteroid - 3-oxosteroid - 3-oxo-delta-5-steroid - Delta-5-steroid - Tertiary alcohol - Cyclic alcohol - Ketone - Nitrile - Carbonitrile - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Alcohol - Aliphatic 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

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