Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H]1CC[C@]2(C)[C@H](CC[C@H]3[C@H]4CC(=O)C[C@]4(C)CC[C@H]23)C1

InChIKey

InChIKey=IFADLLNZMJESQF-WMVRJVICSA-N

Formula

C26H36O4S

Mass

444.63

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Androstane steroids

Intermediate Tree Nodes

Not available

Direct Parent

Androstane steroids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Androstane-skeleton - 16-oxosteroid - Oxosteroid - Benzenesulfonate ester - P-methylbenzenesulfonate - Tosyl compound - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Toluene - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid ester - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ketone - Cyclic ketone - Organooxygen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as androstane steroids. These are steroids with a structure based on the 19-carbon androstane skeleton.

External Descriptors

Not available

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