Structure Information
Structure

Compound Identification

SMILES

CCC1(O)CC2CN(C1)CCC1=C(NC3=CC=CC=C13)C(C2)(C(=O)OC)C1=C(OC)C=C2N(C)C3C4(CCN5CC=CC(CC)(C45)C(O)C3(O)C(=O)NCCNC(=O)C3=C(O)C([125I])=C(C=C3)N=[N+]=[N-])C2=C1

InChIKey

InChIKey=INDAMCROFGPLSO-WJXVBXJFSA-N

Formula

C52H62IN9O9

Mass

1082.027

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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-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 3-alkylindole - Salicylic acid or derivatives - Salicylamide - Benzamide - Benzoic acid or derivatives - Indole - Indole or derivatives - Phenylazide - 2-iodophenol - Dialkylarylamine - Tertiary aliphatic/aromatic amine - 2-halophenol - Benzoyl - Anisole - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - Halobenzene - Iodobenzene - Aralkylamine - Phenol - Monocyclic benzene moiety - Aryl iodide - Benzenoid - Aryl halide - N-alkylpyrrolidine - Piperidine - Cyclic alcohol - Heteroaromatic compound - Methyl ester - Vinylogous acid - Tertiary alcohol - Pyrrolidine - Pyrrole - Amino acid or derivatives - Carboxamide group - Azo compound - 1,2-aminoalcohol - Secondary carboxylic acid amide - Secondary alcohol - Carboxylic acid ester - Tertiary amine - Tertiary aliphatic amine - Azo imide - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Azacycle - Ether - Carboxylic acid derivative - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Amine - Organic zwitterion - Organohalogen compound - Organoiodide - Organopnictogen compound - Organic oxide - Carbonyl group - Organooxygen compound - Organonitrogen 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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