Structure Information
Structure

Compound Identification

SMILES

CN(C)C1=CC=C(C=C1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#CC2=CC=C(Cl)C=C2)[C@@H]2OCC3=CC(=O)CCC3=C12

InChIKey

InChIKey=XURCMPWGZVTZBK-ZDRBTZMISA-N

Formula

C33H34ClNO3

Mass

528.09

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Oxosteroids

Intermediate Tree Nodes

Not available

Direct Parent

Oxosteroids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-oxosteroid - Hydroxysteroid - Oxosteroid - 17-hydroxysteroid - 7-oxasteroid - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Chlorobenzene - Halobenzene - Cyclohexenone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyran - Ynone - Benzenoid - Tertiary alcohol - Cyclic alcohol - Cyclic ketone - Tertiary amine - Ketone - Oxacycle - Organoheterocyclic compound - Dialkyl ether - Ether - Organopnictogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Amine - Hydrocarbon derivative - Alcohol - Organic oxide - Organonitrogen compound - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as oxosteroids. These are steroid derivatives carrying a C=O group attached to steroid skeleton.

External Descriptors

Not available

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