Compound Identification
SMILES
C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(OCC=C)=C4)[C@@H]1C[C@@H](O)[C@@H]2O
InChIKey
InChIKey=GVKVGOGUDSJCLX-YQPXSLGVSA-N
Formula
C21H28O3
Mass
328.452
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-hydroxysteroids 16-alpha-hydroxysteroids Phenanthrenes and derivatives Tetralins Alkyl aryl ethers Secondary alcohols Cyclic alcohols and derivatives 1,2-diols Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Estrane-skeleton - Hydroxysteroid - 16-alpha-hydroxysteroid - 17-hydroxysteroid - 16-hydroxysteroid - Phenanthrene - Tetralin - Alkyl aryl ether - Benzenoid - Cyclic alcohol - Secondary alcohol - 1,2-diol - Ether - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Alcohol - 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
CHEBI:79756 : 17beta-hydroxy steroid - 16alpha-hydroxy steroid