Compound Identification
SMILES
CC[C@H]1C[C@@]2(C)[C@@H](C[C@H]([18F])C2=O)[C@@H]2CCC3=C(C=CC(OS(=O)(=O)C(F)(F)F)=C3)[C@@H]12
InChIKey
InChIKey=OMGFKBJJOHHFOZ-HAGKHEJUSA-N
Formula
C21H24F4O4S
Mass
447.48
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
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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
Halogenated steroids 17-oxosteroids Phenanthrenes and derivatives Tetralins Trifluoromethanesulfonates Sulfonic acid esters Organosulfonic acid esters Sulfonyls Methanesulfonates Alpha-haloketones Trihalomethanes Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Estrane-skeleton - 16-halo-steroid - Halo-steroid - 17-oxosteroid - Oxosteroid - Phenanthrene - Tetralin - Trifluoromethanesulfonate - Sulfonic acid ester - Organosulfonic acid ester - Benzenoid - Organosulfonic acid or derivatives - Sulfonyl - Organic sulfonic acid or derivatives - Alpha-haloketone - Methanesulfonate - Ketone - Trihalomethane - Organooxygen compound - Organofluoride - Organohalogen compound - Halomethane - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Alkyl halide - Organosulfur compound - Alkyl fluoride - 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