Structure Information
Structure

Compound Identification

SMILES

[Na+].CC(C)CCCC(C)[C@H]1CCC2C3C(CC[C@]12C)[C@@]1(C)CCC(CC1=CC3=O)OS([O-])(=O)=O

InChIKey

InChIKey=GXTHZWLVUKTTKK-WPYCEHDGSA-M

Formula

C27H43NaO5S

Mass

502.69

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Cholestane steroids

Intermediate Tree Nodes

Not available

Direct Parent

Cholesterols and derivatives

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Cholesterol - Sulfated steroid skeleton - Oxosteroid - 7-oxosteroid - Delta-5-steroid - Cyclohexenone - Sulfuric acid monoester - Sulfate-ester - Sulfuric acid ester - Alkyl sulfate - Organic sulfuric acid or derivatives - Ketone - Organic alkali metal salt - Organic salt - Organic sodium salt - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organic cation - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as cholesterols and derivatives. These are compounds containing a 3-hydroxylated cholestane core.

External Descriptors

Not available

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