Structure Information
Structure

Compound Identification

SMILES

CC(C)CCCC(C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](CCC=C(C5=CC(C(=O)OC(C)C)=C(O)C(Cl)=C5)C5=CC(C(=O)OC(C)C)=C(O)C(Cl)=C5)CC[C@]4(C)[C@H]3CC[C@]12C

InChIKey

InChIKey=KCQSPSQLSCOINC-SCCGAENTSA-N

Formula

C51H72Cl2O6

Mass

852.03

Export to:

JSON SDF CSV

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 - Diphenylmethane - O-hydroxybenzoic acid ester - Benzoate ester - Salicylic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - 2-halophenol - 2-chlorophenol - Benzoyl - Styrene - Chlorobenzene - Phenol - Halobenzene - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Benzenoid - Vinylogous acid - Carboxylic acid ester - Carboxylic acid derivative - Organohalogen compound - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic oxide - 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

Previous Back Next