Compound Identification
SMILES
COC(=O)C=C1CCC2C3CCC4=CC(=O)C(Br)CC4(C)C3C(=O)CC12C
InChIKey
InChIKey=VGARIQOMXRAOII-UHFFFAOYSA-N
Formula
C22H27BrO4
Mass
435.358
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
Halogenated steroids 3-oxo delta-4-steroids 11-oxosteroids Delta-4-steroids Cyclohexenones Methyl esters Enoate esters Alpha-haloketones Monocarboxylic acids and derivatives Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Progestogin-skeleton - 3-oxo-delta-4-steroid - 3-oxosteroid - Oxosteroid - 11-oxosteroid - 2-halo-steroid - Halo-steroid - Delta-4-steroid - Cyclohexenone - Alpha-haloketone - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carboxylic acid ester - Cyclic ketone - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organobromide - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Alkyl halide - Alkyl bromide - Organohalogen compound - 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