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Structure Information
Structure

Compound Identification

SMILES

COC1=C(O)C=C2CC[C@H]3N(CCC4=CC(O)=C(OC)C(C2=C1)=C34)C(=O)C(F)(F)F

InChIKey

InChIKey=WIIZKNYQCVABAG-CYBMUJFWSA-N

Formula

C21H20F3NO5

Mass

423.388

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Allocolchicine alkaloids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Allocolchicine alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Homoaporphine - Allocolchicine alkaloid skeleton - Tetrahydroisoquinoline - Anisole - Phenol ether - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Azacycle - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as allocolchicine alkaloids. These are alkaloids with a structure based on the tricyclic allocolchicine skeleton, which consists of a dibenzocycloheptane where the cycloheptane moiety carries the N-acetamide group.

External Descriptors

Not available

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