Compound Identification
SMILES
COC1=CC(C=C2C[C@H]3[C@@H]4CCC5=C(C=CC(OCCN6CCCC6)=C5)[C@H]4CC[C@]3(C)C2=O)=CC(OC)=C1OC
InChIKey
InChIKey=JUBUTZARPJLCEI-NPDJUGFLSA-N
Formula
C34H43NO5
Mass
545.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Estrane steroids
-
Class
Steroids and steroid derivatives
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Steroids and steroid derivatives
Subclass
Estrane steroids
Intermediate Tree Nodes
Not available
Direct Parent
Estrane steroids
Alternative Parents
17-oxosteroids Phenanthrenes and derivatives Tetralins Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers N-alkylpyrrolidines Trialkylamines Ketones Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Oxosteroid - Estrane-skeleton - 17-oxosteroid - Phenanthrene - Tetralin - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Pyrrolidine - Tertiary amine - Ketone - Tertiary aliphatic amine - Ether - Azacycle - Organoheterocyclic compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as estrane steroids. These are steroids with a structure based on the estrane skeleton.
External Descriptors
Not available