Structure Information
Structure

Compound Identification

SMILES

C[C@]12C[C@@H]([C@H]3[C@@H](CC=C4CC5(CC[C@H]34)OCCO5)[C@@H]1CCC2=O)C1=CC=C(OS(=O)(=O)C(F)(F)F)C=C1

InChIKey

InChIKey=ORZFMBKWDUQQOB-BAWBHIEYSA-N

Formula

C27H31F3O6S

Mass

540.59

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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 heteropolycyclic compounds

Substituents

Estrane-skeleton - 17-oxosteroid - Oxosteroid - Delta-5-steroid - Phenoxy compound - Trifluoromethanesulfonate - Ketal - Sulfonic acid ester - Organosulfonic acid ester - Benzenoid - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid or derivatives - Methanesulfonate - Organic sulfonic acid or derivatives - Meta-dioxolane - Ketone - Trihalomethane - Acetal - Organoheterocyclic compound - Oxacycle - Organic oxide - Organohalogen compound - Organofluoride - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Aldehyde - Halomethane - Aromatic heteropolycyclic 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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