Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC(COC(=O)C2=C(OCC3=CC=CC(=C3)C(=O)OC)C(Cl)=CC(=C2)C(=CCC[C@H]2CC[C@@]3(C)[C@@H](CC[C@H]4[C@@H]5CC[C@H]([C@H](C)CCCC(C)C)[C@@]5(C)CC[C@H]34)C2)C2=CC(C(=O)OCC3=CC=CC(=C3)C(=O)OC)=C(OCC3=CC=CC(=C3)C(=O)OC)C(Cl)=C2)=CC=C1

InChIKey

InChIKey=OTAVFLOMHJYVMA-DHSOJYCKSA-N

Formula

C81H92Cl2O14

Mass

1360.51

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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 - Hexacarboxylic acid or derivatives - Diphenylmethane - Benzoate ester - Benzyloxycarbonyl - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Styrene - Phenol ether - Phenoxy compound - Alkyl aryl ether - Chlorobenzene - Halobenzene - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Methyl ester - Carboxylic acid ester - Ether - Carboxylic acid derivative - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organochloride - 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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