Compound Identification
SMILES
C[C@]12CC[C@H]3[C@@H](C=CC4=CC(O)C=C[C@H]34)[C@@H]1CCC2=O
InChIKey
InChIKey=WSFPLYXSEDFVOZ-YFRXESGTSA-N
Formula
C18H22O2
Mass
270.372
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Estrane steroids
- Level 5 Estrogens and 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
Estrogens and derivatives
Alternative Parents
3-hydroxy delta-1,4-steroids 17-oxosteroids Delta-1,4-steroids Secondary alcohols Ketones Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Estrogen-skeleton - 3-hydroxy-delta-1,4-steroid - 3-hydroxysteroid - Oxosteroid - 17-oxosteroid - Hydroxysteroid - Delta-1,4-steroid - Secondary alcohol - Ketone - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Alcohol - Organooxygen compound - Organic oxide - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as estrogens and derivatives. These are steroids with a structure containing a 3-hydroxylated estrane.
External Descriptors
Not available