Compound Identification
SMILES
[Na+].CC12CCC3C(CCC4CC(=O)CCC34C)C1CCC2C(=O)COC(=O)CCC([O-])=O
InChIKey
InChIKey=BFQDICGJHAONBN-UHFFFAOYSA-M
Formula
C25H35NaO6
Mass
454.539
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 3-oxosteroids Alpha-acyloxy ketones Dicarboxylic acids and derivatives Cyclic ketones Carboxylic acid salts Carboxylic acid esters Carboxylic acids Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Progestogin-skeleton - 20-oxosteroid - 3-oxosteroid - Oxosteroid - Alpha-acyloxy ketone - Dicarboxylic acid or derivatives - Carboxylic acid ester - Carboxylic acid salt - Ketone - Cyclic ketone - Organic alkali metal salt - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic sodium salt - Organic salt - Organic cation - 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