Compound Identification
SMILES
CC(C)C1=CC2=C(C=C1)C1(C)CCC(C)(CNC(=O)CCC(=O)OCC(=O)C3(O)CCC4C5CCC6=CC(=O)CCC6(C)C5CCC34C)CC1CC2
InChIKey
InChIKey=WGFQTQBPYLZXOP-UHFFFAOYSA-N
Formula
C45H63NO6
Mass
714.0
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 17-hydroxysteroids 3-oxo delta-4-steroids Delta-4-steroids Hydrophenanthrenes Tetralins Alpha-acyloxy ketones Cyclohexenones N-acyl amines Tertiary alcohols Alpha-hydroxy ketones Secondary carboxylic acid amides Cyclic alcohols and derivatives Carboxylic acid esters Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Progestogin-skeleton - 20-oxosteroid - 3-oxo-delta-4-steroid - 3-oxosteroid - Hydroxysteroid - Oxosteroid - 17-hydroxysteroid - Delta-4-steroid - Hydrophenanthrene - Phenanthrene - Tetralin - Cyclohexenone - Alpha-acyloxy ketone - Benzenoid - Fatty acyl - N-acyl-amine - Fatty amide - Alpha-hydroxy ketone - Cyclic alcohol - Tertiary alcohol - Carboxamide group - Carboxylic acid ester - Cyclic ketone - Secondary carboxylic acid amide - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - 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