Compound Identification
SMILES
C[C@]12CC=C3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C(=O)CN1CCNCC1
InChIKey
InChIKey=GJTROIMIHOJIPQ-JXEAHHCRSA-N
Formula
C25H36N2O3
Mass
412.574
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-oxosteroids Cyclohexenones N-alkylpiperazines 1,3-aminoalcohols Tertiary alcohols Alpha-amino ketones Alpha-hydroxy ketones Trialkylamines Cyclic alcohols and derivatives Azacyclic compounds Dialkylamines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Progestogin-skeleton - 20-oxosteroid - 3-oxosteroid - Hydroxysteroid - Oxosteroid - 17-hydroxysteroid - Cyclohexenone - N-alkylpiperazine - 1,4-diazinane - Piperazine - 1,3-aminoalcohol - Alpha-aminoketone - Alpha-hydroxy ketone - Cyclic alcohol - Tertiary alcohol - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Ketone - Organoheterocyclic compound - Azacycle - Secondary amine - Secondary aliphatic amine - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Alcohol - Hydrocarbon derivative - Organopnictogen compound - Organic oxide - Organooxygen compound - Organonitrogen 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