Structure Information
Structure

Compound Identification

SMILES

C[C@H](CCC(O)=O)[C@H]1CCC2C3CCC4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)CCNC(=O)CCCCCNC(=O)CCCCC1SCC2NC(=O)NC12

InChIKey

InChIKey=CNHZQNCLFFVYSU-BEHPHGPYSA-N

Formula

C43H70N4O7S

Mass

787.11

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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

Aliphatic heteropolycyclic compounds

Substituents

Bile acid, alcohol, or derivatives - Steroid ester - Biotin_derivative - Beta amino acid or derivatives - Thienoimidazolidine - Dicarboxylic acid or derivatives - Fatty amide - Fatty acyl - Imidazolidinone - N-acyl-amine - Imidazolidine - Thiophene - Thiolane - Carboxamide group - Carboxylic acid ester - Urea - Secondary carboxylic acid amide - Dialkylthioether - Organoheterocyclic compound - Azacycle - Carboxylic acid - Carboxylic acid derivative - Thioether - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - Aliphatic 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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