Structure Information
Structure

Compound Identification

SMILES

C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2OC(=O)C1=CC=CC=C1C#N

InChIKey

InChIKey=TZRNKHTWSSBGQA-ZLQWOROUSA-N

Formula

C27H31NO3

Mass

417.549

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Steroid esters

Intermediate Tree Nodes

Not available

Direct Parent

Steroid esters

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Steroid ester - Androgen-skeleton - Androstane-skeleton - 3-oxo-delta-4-steroid - 3-oxosteroid - Oxosteroid - Delta-4-steroid - Benzoate ester - Benzoic acid or derivatives - Benzonitrile - Benzoyl - Cyclohexenone - Monocyclic benzene moiety - Benzenoid - Cyclic ketone - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Nitrile - Carbonitrile - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Cyanide - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as steroid esters. These are compounds containing a steroid moiety which bears a carboxylic acid ester group.

External Descriptors

Not available

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