Structure Information
Structure

Compound Identification

SMILES

CCC1=C[C@H]2CN(C1)CCC1=C(NC3=CC=CC=C13)[C@@](C2)(C(=O)OC)C1=C(OC)C=C2N(C)[C@H]3C(=C[C@]4(CC)C=CCN5CC[C@]3([C@H]45)C2=C1)C(=O)NC

InChIKey

InChIKey=JGITZZVWSOYCMM-ICZUOTQLSA-N

Formula

C44H53N5O4

Mass

715.939

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Vinca alkaloids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Vinca alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Vinca alkaloid skeleton - Carbazole - Quinoline-6-carboxamide - 3-alkylindole - Indole - Indole or derivatives - Anisole - Phenol ether - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - Aralkylamine - Benzenoid - N-alkylpyrrolidine - Methyl ester - Heteroaromatic compound - Pyrrole - Pyrrolidine - Tertiary aliphatic amine - Amino acid or derivatives - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Organic oxygen compound - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxide - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as vinca alkaloids. These are alkaloids with a dimeric chemical structure composed of an indole nucleus (catharanthine), and a dihydroindole nucleus (vindoline), joined together.

External Descriptors

Not available

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