Compound Identification
SMILES
CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(Cl)C4=C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=O
InChIKey
InChIKey=QQEHDZXXCDSAFE-JBSAMAPISA-N
Formula
C23H31ClO4
Mass
406.95
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
Steroid esters 20-oxosteroids Halogenated steroids 3-beta-hydroxysteroids Alpha-acyloxy ketones Secondary alcohols Ketones Carboxylic acid esters Vinyl chlorides Monocarboxylic acids and derivatives Chloroalkenes Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Progestogin-skeleton - 20-oxosteroid - Steroid ester - 3-hydroxysteroid - 6-halo-steroid - Halo-steroid - Hydroxysteroid - Oxosteroid - 3-beta-hydroxysteroid - Alpha-acyloxy ketone - Secondary alcohol - Carboxylic acid ester - Ketone - Chloroalkene - Carboxylic acid derivative - Haloalkene - Vinyl halide - Monocarboxylic acid or derivatives - Vinyl chloride - Hydrocarbon derivative - Alcohol - Organic oxygen compound - Carbonyl group - Organohalogen compound - Organochloride - Organooxygen compound - Organic oxide - 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