Structure Information
Structure

Compound Identification

SMILES

C[C@H](CCC(=O)NC1=NN=C(S1)S(N)(=O)=O)[C@H]1CCC2C3C(CC(=O)[C@]12C)[C@@]1(C)CCC(=O)C[C@H]1CC3=O

InChIKey

InChIKey=WLFJOGAKBXGCPY-JGEAXKCFSA-N

Formula

C26H36N4O6S2

Mass

564.72

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Bile acids, alcohols and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Bile acids, alcohols and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Bile acid, alcohol, or derivatives - 3-oxosteroid - 12-oxosteroid - Oxosteroid - 7-oxosteroid - 3-oxo-5-beta-steroid - 1,3,4-thiadiazole-2-sulfonamide - N-arylamide - Organosulfonic acid amide - Fatty amide - Fatty acyl - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Thiadiazole - Heteroaromatic compound - Sulfonyl - Azole - Organosulfonic acid or derivatives - Carboxamide group - Ketone - Secondary carboxylic acid amide - Cyclic ketone - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as bile acids, alcohols and derivatives. These are organic compounds containing an alcohol or acid derivative of cholic acid.

External Descriptors

Not available

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