Structure Information
Structure

Compound Identification

SMILES

[Na+].[Na+].[Na+].CC(C)C(=C)CCC(C)[C@H]1CC[C@@]2(C)[C@@H]3C[C@H](OS([O-])(=O)=O)[C@H]4C[C@H](OS([O-])(=O)=O)[C@H](C[C@]4(C)C3=CC[C@]12C)OS([O-])(=O)=O

InChIKey

InChIKey=IBDAOLNXQSCECS-ZPFOQQDFSA-K

Formula

C29H45Na3O12S3

Mass

750.82

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Ergostane steroids

Intermediate Tree Nodes

Not available

Direct Parent

Ergostane steroids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Ergostane-skeleton - Sulfated steroid skeleton - 14-alpha-methylsteroid - Sulfuric acid monoester - Sulfate-ester - Alkyl sulfate - Sulfuric acid ester - Organic sulfuric acid or derivatives - Organic alkali metal salt - Organic oxide - Organic oxygen compound - Organooxygen compound - Organic salt - Organic sodium salt - Hydrocarbon derivative - Organic cation - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as ergostane steroids. These are steroids with a structure based on the ergostane skeleton, which arises from the methylation of cholestane at the 24-position.

External Descriptors

Not available

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