Compound Identification
SMILES
CCC(=O)OCC(=O)C1(OC(=O)CC)C(C)(O)CC2C3CCC4=CC(=O)C=CC4(C)C3(Cl)C(O)CC12C
InChIKey
InChIKey=BROZXJKELHEDOU-UHFFFAOYSA-N
Formula
C28H37ClO8
Mass
537.05
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 11-hydroxysteroids 16-hydroxysteroids Halogenated steroids 3-oxo delta-1,4-steroids Delta-1,4-steroids Alpha-acyloxy ketones Dicarboxylic acids and derivatives Tertiary alcohols Secondary alcohols Cyclic ketones Cyclic alcohols and derivatives Chlorohydrins Carboxylic acid esters Alkyl chlorides Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Progestogin-skeleton - 20-oxosteroid - Steroid ester - 3-oxo-delta-1,4-steroid - 3-oxosteroid - 9-halo-steroid - Halo-steroid - Hydroxysteroid - Oxosteroid - 11-hydroxysteroid - 16-hydroxysteroid - Delta-1,4-steroid - Alpha-acyloxy ketone - Dicarboxylic acid or derivatives - Tertiary alcohol - Cyclic alcohol - Cyclic ketone - Secondary alcohol - Carboxylic acid ester - Chlorohydrin - Ketone - Halohydrin - Carboxylic acid derivative - Organohalogen compound - Organochloride - Carbonyl group - Alkyl halide - Organic oxide - Organooxygen compound - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Alkyl chloride - 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