Compound Identification
SMILES
C[C@@]12C[C@H](O)C[C@H]1[C@@H]1CCC3=C(C=CC(OCC=C)=C3)[C@H]1CC2
InChIKey
InChIKey=DGQZPNNDBCCCRJ-TZSPXAHUSA-N
Formula
C21H28O2
Mass
312.453
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Estrane steroids
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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
16-alpha-hydroxysteroids Phenanthrenes and derivatives Tetralins Alkyl aryl ethers Secondary alcohols Cyclic alcohols and derivatives Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Estrane-skeleton - Hydroxysteroid - 16-alpha-hydroxysteroid - 16-hydroxysteroid - Phenanthrene - Tetralin - Alkyl aryl ether - Benzenoid - Cyclic alcohol - Secondary alcohol - Ether - Organooxygen compound - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Aromatic homopolycyclic 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