Structure Information
Structure

Compound Identification

SMILES

CC(CCC(O)=O)C1CCC2C3CCC4CC(CCC4(C)C3CC(OC(=O)CC3=CC=C(C=C3)N(CCCl)CCCl)C12C)OC(=O)CC1=CC=C(C=C1)N(CCCl)CCCl

InChIKey

InChIKey=YHPXZUQZLHUBSP-UHFFFAOYSA-N

Formula

C48H66Cl4N2O6

Mass

908.86

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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 homopolycyclic compounds

Substituents

Bile acid, alcohol, or derivatives - Steroid ester - Tricarboxylic acid or derivatives - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Nitrogen mustard - Benzenoid - Monocyclic benzene moiety - Amino acid - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Carbonyl group - Amine - Alkyl halide - Alkyl chloride - Aromatic homopolycyclic 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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