Structure Information
Structure

Compound Identification

SMILES

C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2[C@@H]3C[C@@H](OS(C)(=O)=O)[C@H]4CC(=O)[C@@H]5O[C@@H]5[C@]4(C)[C@H]3CC[C@]12C

InChIKey

InChIKey=XLEQBUJYAMGQIN-CGYYCCGMSA-N

Formula

C28H46O6S

Mass

510.73

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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 heteropolycyclic compounds

Substituents

Cholesterol-skeleton - 25-hydroxysteroid - 1-alpha,2-epoxy-3-oxo-5-alpha-steroid - 1,2-epoxy-3-oxo-steroid - 3-oxosteroid - Oxosteroid - 3-oxo-5-alpha-steroid - Oxepane - Organosulfonic acid ester - Sulfonic acid ester - Tertiary alcohol - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methanesulfonate - Ketone - Organoheterocyclic compound - Oxacycle - Dialkyl ether - Oxirane - Ether - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Alcohol - Organooxygen compound - Organosulfur compound - Aliphatic heteropolycyclic 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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