Structure Information
Structure

Compound Identification

SMILES

C[C@H]1[C@@H]2CC[C@]3(C)C(=CC(=O)C(C)[C@@]3(C)CCC3(CCC(C)(C)CC3)NC(=O)C(C)(F)F)[C@@]2(C)[C@H]2O[C@@]2(C#N)C1=O

InChIKey

InChIKey=DTKLJVRZSQLHFY-PADDRWIHSA-N

Formula

C33H46F2N2O4

Mass

572.738

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Oxosteroids

Intermediate Tree Nodes

3-oxosteroids - 1,2-epoxy-3-oxosteroids

Direct Parent

1-alpha,2-epoxy-3-oxo-5-alpha-steroids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

1-alpha,2-epoxy-3-oxo-5-alpha-steroid - 3-oxo-5-alpha-steroid - Oxepane - Cyclohexenone - Carboxamide group - Ketone - Secondary carboxylic acid amide - Cyclic ketone - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Carbonitrile - Nitrile - Oxacycle - Organoheterocyclic compound - Organohalogen compound - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Alkyl fluoride - Alkyl halide - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-alpha,2-epoxy-3-oxo-5-alpha-steroids. These are 3-oxo-5-alpha-steroids sharing the carbon atoms C1 and C2 wit an epoxide ring to form a 1-alpha,2-epoxy moiety.

External Descriptors

Not available

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