Structure Information
Structure

Compound Identification

SMILES

CC(O)C1CCC2C3CCC4CC(CCC4(C)C3CCC12C)SC(=O)C1=CC=CC=C1

InChIKey

InChIKey=DVTUTZSCGRMGRB-UHFFFAOYSA-N

Formula

C28H40O2S

Mass

440.69

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Pregnane steroids

Intermediate Tree Nodes

Not available

Direct Parent

Pregnane steroids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Pregnane-skeleton - 20-hydroxysteroid - Hydroxysteroid - Thiobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Benzenoid - Monocyclic benzene moiety - Carbothioic s-ester - Thiocarboxylic acid ester - Secondary alcohol - Sulfenyl compound - Thiocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Alcohol - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as pregnane steroids. These are steroids with a structure based on the 21-carbon pregnane skeleton.

External Descriptors

Not available

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