Structure Information
Structure

Compound Identification

SMILES

C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(OC(=O)C3=CC=CC=C3)=C4)[C@@H]1CC[C@@H]2OC(=O)COC(=O)CCCC1=CC=C(NCCCl)C=C1

InChIKey

InChIKey=JAGNOEAYHUNZEL-AAPSUCHYSA-N

Formula

C39H44ClNO6

Mass

658.23

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Steroid esters

Intermediate Tree Nodes

Not available

Direct Parent

Steroid esters

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Steroid ester - Estrane-skeleton - Phenanthrene - Benzoate ester - Phenol ester - Tetralin - Benzoic acid or derivatives - Phenylalkylamine - Aniline or substituted anilines - Benzoyl - Secondary aliphatic/aromatic amine - Benzenoid - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Amino acid or derivatives - Carboxylic acid ester - Secondary amine - Carboxylic acid derivative - Alkyl halide - Amine - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Alkyl chloride - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as steroid esters. These are compounds containing a steroid moiety which bears a carboxylic acid ester group.

External Descriptors

Not available

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