Compound Identification
SMILES
C[C@]12CC[C@H]3[C@@H](CCC4=C3C(=CC(=C4)S(O)(=O)=O)C(F)(F)F)[C@@H]1CC[C@@H]2C(=O)CCC1=CC=CC=C1
InChIKey
InChIKey=WTWOZBNURQMHLW-PUJHRNRVSA-N
Formula
C28H31F3O4S
Mass
520.61
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Steroids and steroid derivatives
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Subclass
Oxosteroids
- Level 5 20-oxosteroids
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Subclass
Oxosteroids
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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
Oxosteroids
Intermediate Tree Nodes
Not available
Direct Parent
20-oxosteroids
Alternative Parents
Estrane steroids Phenanthrenes and derivatives Tetralins 1-sulfo,2-unsubstituted aromatic compounds Benzene and substituted derivatives Sulfonyls Organosulfonic acids Ketones Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
20-oxosteroid - Estrane-skeleton - Phenanthrene - Tetralin - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Benzenoid - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ketone - Organic oxide - Organooxygen compound - Organofluoride - Organohalogen compound - Organosulfur compound - Alkyl fluoride - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Alkyl halide - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as 20-oxosteroids. These are steroid derivatives carrying a C=O group at the 20-position of the steroid skeleton.
External Descriptors
Not available