Compound Identification
SMILES
C[C@]12CCC3C(CCC4=CC(O)=C([18F])C=C34)C1CC[C@@H]2O
InChIKey
InChIKey=HDPXSAXRLVDBIR-FINZXDKYSA-N
Formula
C18H23FO2
Mass
289.381
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
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Subclass
Estrane steroids
- Level 5 Estrogens and derivatives
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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
Estrogens and derivatives
Alternative Parents
Halogenated steroids 3-hydroxysteroids 17-hydroxysteroids Phenanthrenes and derivatives Tetralins O-fluorophenols 1-hydroxy-2-unsubstituted benzenoids Aryl fluorides Secondary alcohols Cyclic alcohols and derivatives Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Estrogen-skeleton - 3-hydroxysteroid - 17-hydroxysteroid - 2-halo-steroid - Halo-steroid - Hydroxysteroid - Phenanthrene - Tetralin - 2-fluorophenol - 1-hydroxy-2-unsubstituted benzenoid - Aryl fluoride - Benzenoid - Aryl halide - Cyclic alcohol - Secondary alcohol - Organofluoride - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organohalogen compound - Aromatic 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