Structure Information
Structure

Compound Identification

SMILES

CC[C@H]1CN(CCO1)[C@H]1C[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC[C@H](C(C)=O)[C@@]4(C)CC(=O)[C@H]23)C[C@@H]1O

InChIKey

InChIKey=PYYXBHCJGTUGIW-MWVMWFJTSA-N

Formula

C27H43NO4

Mass

445.644

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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

Aliphatic heteropolycyclic compounds

Substituents

Progestogin-skeleton - 20-oxosteroid - 3-hydroxysteroid - Hydroxysteroid - 11-oxosteroid - Oxosteroid - 3-alpha-hydroxysteroid - Morpholine - Oxazinane - Cyclic alcohol - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Ketone - Oxacycle - Organoheterocyclic compound - Azacycle - Dialkyl ether - Ether - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Alcohol - Organic oxide - Aliphatic 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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