Compound Identification
SMILES
CC(NCCC1=CC=C(Cl)C=C1)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
InChIKey
InChIKey=HSIJEROBGRGKNS-UHFFFAOYSA-N
Formula
C29H42ClNO
Mass
456.11
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
Pregnane-type alkaloids 3-hydroxy delta-5-steroids Delta-5-steroids Azasteroids and derivatives Phenethylamines Alkaloids and derivatives Chlorobenzenes Aralkylamines Aryl chlorides Secondary alcohols Cyclic alcohols and derivatives Dialkylamines Organopnictogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
22-azasteroid - Progestogin-skeleton - Pregnane-type alkaloid - Steroidal alkaloid - 3-hydroxy-delta-5-steroid - 3-hydroxysteroid - Hydroxysteroid - Azasteroid - Delta-5-steroid - Phenethylamine - Alkaloid or derivatives - Aralkylamine - Halobenzene - Chlorobenzene - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Cyclic alcohol - Secondary alcohol - Secondary amine - Secondary aliphatic amine - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Organohalogen compound - Organochloride - Amine - Alcohol - 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