Compound Identification
SMILES
CC(=O)OCC(=O)C1(O)CCC2C3CC(Cl)C4(Cl)CC(O)CCC4(C)C3CCC12C
InChIKey
InChIKey=RBBIHEUAYKTXTF-UHFFFAOYSA-N
Formula
C23H34Cl2O5
Mass
461.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Lipids and lipid-like molecules
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
20-oxosteroids Halogenated steroids 3-hydroxysteroids 17-hydroxysteroids Alpha-acyloxy ketones Tertiary alcohols Alpha-hydroxy ketones Secondary alcohols Cyclic alcohols and derivatives Carboxylic acid esters Monocarboxylic acids and derivatives Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Progestogin-skeleton - 20-oxosteroid - 3-hydroxysteroid - 6-halo-steroid - 5-halo-steroid - Halo-steroid - Hydroxysteroid - Oxosteroid - 17-hydroxysteroid - Alpha-acyloxy ketone - Tertiary alcohol - Alpha-hydroxy ketone - Cyclic alcohol - Secondary alcohol - Carboxylic acid ester - Ketone - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Alcohol - Organic oxygen compound - Organooxygen compound - Organic oxide - Organohalogen compound - Hydrocarbon derivative - Organochloride - Alkyl chloride - Alkyl halide - Carbonyl group - Aliphatic homopolycyclic 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