Compound Identification
SMILES
CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C.CCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=C(C=CC(O)=C4)[C@H]3CC[C@]12C
InChIKey
InChIKey=OLRIHCGDXVHCNC-PAYLWKAUSA-N
Formula
C44H62O5
Mass
670.975
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 3-oxo delta-4-steroids 3-hydroxysteroids Delta-4-steroids Phenanthrenes and derivatives Tetralins Cyclohexenones 1-hydroxy-2-unsubstituted benzenoids Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Progestogin-skeleton - Steroid ester - 20-oxosteroid - 3-hydroxysteroid - 3-oxo-delta-4-steroid - 3-oxosteroid - Oxosteroid - Hydroxysteroid - Delta-4-steroid - Phenanthrene - Tetralin - 1-hydroxy-2-unsubstituted benzenoid - Cyclohexenone - Phenol - Benzenoid - Carboxylic acid ester - Cyclic ketone - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Aromatic 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