Structure Information
Structure

Compound Identification

SMILES

CC12CC(O)C3(F)C(CC(F)C4=CC(=O)C=CC34C)C1CC(O)C2(OS(O)(=O)=O)C(=O)CO

InChIKey

InChIKey=NIRADOKNGQOYRK-UHFFFAOYSA-N

Formula

C21H26F2O9S

Mass

492.49

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Sulfated steroids

Intermediate Tree Nodes

Not available

Direct Parent

Sulfated steroids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Progestogin-skeleton - 21-hydroxysteroid - Sulfated steroid skeleton - Pregnane-skeleton - 20-oxosteroid - 3-oxo-delta-1,4-steroid - 3-oxosteroid - 9-halo-steroid - 6-halo-steroid - 16-hydroxysteroid - 11-hydroxysteroid - Halo-steroid - Hydroxysteroid - Oxosteroid - Delta-1,4-steroid - Sulfuric acid ester - Alkyl sulfate - Sulfate-ester - Sulfuric acid monoester - Organic sulfuric acid or derivatives - Alpha-hydroxy ketone - Cyclic alcohol - Ketone - Secondary alcohol - Fluorohydrin - Cyclic ketone - Halohydrin - Organohalogen compound - Organofluoride - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Primary alcohol - Alkyl halide - Organic oxygen compound - Organic oxide - Alcohol - Alkyl fluoride - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as sulfated steroids. These are sterol lipids containing a sulfate group attached to the steroid skeleton.

External Descriptors

Not available

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