Structure Information
Structure

Compound Identification

SMILES

C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CS

InChIKey

InChIKey=NJWBJOCSLKTDJR-ZPOLXVRWSA-N

Formula

C21H28O4S

Mass

376.51

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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

20-oxosteroids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

20-oxosteroid - Diterpenoid - Androgen-skeleton - Androstane-skeleton - 17-hydroxysteroid - 11-oxosteroid - Hydroxysteroid - 3-oxosteroid - 3-oxo-delta-4-steroid - Delta-4-steroid - Cyclohexenone - Acyloin - Alpha,beta-unsaturated ketone - Tertiary alcohol - Enone - Cyclic alcohol - Alpha-hydroxy ketone - Acryloyl-group - Cyclic ketone - Ketone - Alkylthiol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Alcohol - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as 20-oxosteroids. These are steroid derivatives carrying a C=O group at the 20-position of the steroid skeleton.

External Descriptors

Not available

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