Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(OC)C(Cl)=CC(=C1)C(=CCNC1CCC2(C)C(CCC3C4CCC(C(C)CCCC(C)C)C4(C)CCC23)C1)C1=CC(C(=O)OC)=C(OC)C(Cl)=C1

InChIKey

InChIKey=ZYQXAHJPKLUZIV-UHFFFAOYSA-N

Formula

C48H67Cl2NO6

Mass

824.97

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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

Cholestane steroids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Cholestane-skeleton - Pregnane-type alkaloid - Steroidal alkaloid - Azasteroid - Diphenylmethane - O-methoxybenzoic acid or derivatives - Benzoate ester - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Alkaloid or derivatives - Benzoic acid or derivatives - Methoxybenzene - Anisole - Benzoyl - Phenoxy compound - Phenol ether - Styrene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Ether - Secondary aliphatic amine - Secondary amine - Organooxygen compound - Organohalogen compound - Organic oxide - Hydrocarbon derivative - Organochloride - Organic nitrogen compound - Amine - Organopnictogen compound - Organonitrogen compound - Organic oxygen compound - 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

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