Structure Information
Structure

Compound Identification

SMILES

C[C@]12CC[C@H]3[C@@H](CC=C4CC5(CC[C@]34C)OCCO5)[C@@H]1CC[C@]2(O)C#N

InChIKey

InChIKey=VRSHJJXUDZAQKD-CEGNMAFCSA-N

Formula

C22H31NO3

Mass

357.494

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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

Aliphatic heteropolycyclic compounds

Substituents

17-hydroxysteroid - Hydroxysteroid - Estrane-skeleton - Delta-5-steroid - Ketal - Tertiary alcohol - Cyclic alcohol - Meta-dioxolane - Alpha-hydroxynitrile - Cyanohydrin - Oxacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Acetal - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Alcohol - Aliphatic heteropolycyclic 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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