Structure Information
Structure

Compound Identification

SMILES

C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(OS(=O)(=O)C(F)(F)F)=C4)[C@@H]1CCC2=O

InChIKey

InChIKey=PPMJOXGHOQFVEM-CBZIJGRNSA-N

Formula

C19H21F3O4S

Mass

402.43

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Estrane-skeleton - 17-oxosteroid - Oxosteroid - Phenanthrene - Tetralin - Trifluoromethanesulfonate - Benzenoid - Sulfonic acid ester - Organosulfonic acid ester - Methanesulfonate - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Trihalomethane - Ketone - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organofluoride - Organohalogen compound - Halomethane - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - 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

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