Compound Identification
SMILES
CSC(=O)C(O)C12OC(C)(C)C(C)(CC(O1)C(C)C1CCC3C4C(O)CC5=CC(=O)C=CC5(C)C4CCC13C)O2
InChIKey
InChIKey=IEAFGRSTVJUPIC-UHFFFAOYSA-N
Formula
C32H46O7S
Mass
574.77
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
3-oxo delta-1,4-steroids 7-hydroxysteroids Delta-1,4-steroids 1,3-dioxepanes Carboxylic acid orthoesters Ortho esters 1,3-dioxanes 1,3-dioxolanes Secondary alcohols Cyclic ketones Cyclic alcohols and derivatives Carbothioic S-esters Thioesters Carboxylic acids and derivatives Sulfenyl compounds Oxacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Progestogin-skeleton - Hydroxysteroid - 3-oxo-delta-1,4-steroid - 3-oxosteroid - Oxosteroid - 7-hydroxysteroid - Delta-1,4-steroid - 1,3-dioxepane - Dioxepane - Ortho ester - Carboxylic acid orthoester - Meta-dioxane - Meta-dioxolane - Cyclic alcohol - Secondary alcohol - Carbothioic s-ester - Orthocarboxylic acid derivative - Ketone - Thiocarboxylic acid ester - Cyclic ketone - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Sulfenyl compound - Thiocarboxylic acid or derivatives - Carbonyl group - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organosulfur compound - Organooxygen compound - Aliphatic heteropolycyclic 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