Structure Information
Structure

Compound Identification

SMILES

COC1=CC2(CC[C@@H]3N(CCC4=CC(OC)=C(O)C2=C34)S(=O)(=O)C(F)(F)F)C=C(OC)C1=O

InChIKey

InChIKey=BQNWDGNXIBXJIH-LBPRGKRZSA-N

Formula

C21H22F3NO7S

Mass

489.46

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Homoproaporphines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Homoproaporphines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Homoproaporphine - Tetrahydroisoquinoline - Tetralin - Anisole - Phenol ether - Alkyl aryl ether - Phenol - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Cyclic ketone - Ketone - Trihalomethane - Azacycle - Organoheterocyclic compound - Ether - Alkyl fluoride - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Halomethane - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Alkyl halide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as homoproaporphines. These are analogues of proaporphines with the difference that the spirocyclohexenol ring is joined to a cyclohexane instead of a cyclopentane.

External Descriptors

Not available

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