Compound Identification
SMILES
CC12CCC3C(CCC4=CC(=O)CCC34C)C1CCC2(O)C(=O)COC(=O)CCC(=O)NCCC1=CC=CC=C1
InChIKey
InChIKey=SQZLURXSKWOJNM-UHFFFAOYSA-N
Formula
C33H43NO6
Mass
549.708
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 Alpha-acyloxy ketones Cyclohexenones Benzene and substituted derivatives N-acyl amines Tertiary alcohols Alpha-hydroxy ketones Cyclic alcohols and derivatives Carboxylic acid esters Secondary carboxylic acid amides Monocarboxylic acids and derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Progestogin-skeleton - 20-oxosteroid - 3-oxo-delta-4-steroid - 3-oxosteroid - Hydroxysteroid - Oxosteroid - 17-hydroxysteroid - Delta-4-steroid - Cyclohexenone - Alpha-acyloxy ketone - Fatty acyl - Fatty amide - N-acyl-amine - Monocyclic benzene moiety - Benzenoid - Tertiary alcohol - Cyclic alcohol - Alpha-hydroxy ketone - Carboxamide group - Carboxylic acid ester - Cyclic ketone - Secondary carboxylic acid amide - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - 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