Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC=C1N1CCN(CC(=O)[C@@]2(O)CCC3C4CCC5=CC(=O)CC[C@]5(C)C4=CC[C@]23C)CC1

InChIKey

InChIKey=TZTMJQMNXGCUIC-ACTAVUCISA-N

Formula

C32H42N2O4

Mass

518.698

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Pregnane steroids

Intermediate Tree Nodes

Not available

Direct Parent

Gluco/mineralocorticoids, progestogins and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Progestogin-skeleton - 20-oxosteroid - 3-oxosteroid - 17-hydroxysteroid - Oxosteroid - Hydroxysteroid - N-arylpiperazine - Phenylpiperazine - Aminophenyl ether - Methoxyaniline - Tertiary aliphatic/aromatic amine - Phenoxy compound - Anisole - Methoxybenzene - Aniline or substituted anilines - Dialkylarylamine - Phenol ether - N-alkylpiperazine - Alkyl aryl ether - Cyclohexenone - Monocyclic benzene moiety - 1,4-diazinane - Benzenoid - Piperazine - Tertiary alcohol - Alpha-aminoketone - Alpha-hydroxy ketone - 1,3-aminoalcohol - Cyclic alcohol - Cyclic ketone - Ketone - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Azacycle - Ether - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organopnictogen compound - Amine - Organic nitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as gluco/mineralocorticoids, progestogins and derivatives. These are steroids with a structure based on a hydroxylated prostane moiety.

External Descriptors

Not available

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