Structure Information
Structure

Compound Identification

SMILES

CC[C@H]1C[C@@H]2CN(C1)CCC1=C(NC3=CC=CC=C13)[C@@](C2)(C(=O)OC)C1=C(OC)C=C2N[C@H]3[C@H](C[C@]4(CC)C=CCN5CC[C@]3([C@H]45)C2=C1)C(=O)OC

InChIKey

InChIKey=DATWZNKPKOHOGS-FXGAJXKSSA-N

Formula

C43H54N4O5

Mass

706.928

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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 - 3-alkylindole - Indole - Indole or derivatives - Dihydroindole - Anisole - Phenol ether - Alkyl aryl ether - Aralkylamine - Secondary aliphatic/aromatic amine - Dicarboxylic acid or derivatives - Piperidine - Benzenoid - N-alkylpyrrolidine - Pyrrolidine - Pyrrole - Methyl ester - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Secondary amine - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Ether - Amine - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen 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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