Structure Information
Structure

Compound Identification

SMILES

CC(C1C(Br)CC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(C)=O)C1CCC(C)CN1C#N

InChIKey

InChIKey=OXEZESWCAIDKNU-UHFFFAOYSA-N

Formula

C30H45BrN2O2

Mass

545.606

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Steroidal alkaloids

Intermediate Tree Nodes

Not available

Direct Parent

22,26-epiminocholestanes

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

22,26-epiminocholestane skeleton - Pregnane-skeleton - Steroid ester - Halo-steroid - 16-halo-steroid - Delta-5-steroid - Piperidine - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl bromide - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 22,26-epiminocholestanes. These are steroid alkaloids obtained by reduction of spirosolane through opening of the E-ring.

External Descriptors

Not available

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