Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C(OC)=C2C(CCC(NC(C)=O)C3=C2C=CC(NC(=O)C(C)NC(=O)OCC2=CC=CC=C2)=C3)=C1

InChIKey

InChIKey=KBWMVXCRYHTQIX-UHFFFAOYSA-N

Formula

C31H35N3O7

Mass

561.635

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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 homopolycyclic compounds

Substituents

Allocolchicine alkaloid skeleton - Alpha-amino acid amide - Alanine or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Anisole - N-arylamide - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Acetamide - Carbamic acid ester - Carboxamide group - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic homopolycyclic 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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