Structure Information
Structure

Compound Identification

SMILES

CO[C@@H]1C[C@H]2[C@@H]3CC[C@H]([C@H](C)[C@@H](OS(C)(=O)=O)C(=C/C(C)C)\[S@](=O)C4=CC=C(C)C=C4)[C@@]3(C)CC[C@@H]2[C@@]2(C)CC[C@@H]3C[C@]123

InChIKey

InChIKey=ILBWTKWEVJODEF-GPDPIPGHSA-N

Formula

C36H54O5S2

Mass

630.94

Export to:

JSON SDF CSV

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

Cholestane steroids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Cholestane-skeleton - Bile acid, alcohol, or derivatives - Phenyl sulfoxide - Toluene - Monocyclic benzene moiety - Sulfonic acid ester - Organosulfonic acid ester - Benzenoid - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methanesulfonate - Sulfoxide - Ether - Sulfinyl compound - Dialkyl ether - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as cholestane steroids. These are steroids with a structure containing the 27-carbon cholestane skeleton.

External Descriptors

Not available

Previous Back Next