Structure Information
Structure

Compound Identification

SMILES

OS(O)(=O)=O.CC[C@]1(O)CC2CN(C1)CCC1=C(NC3=CC=CC=C13)[C@@](C2)(C(=O)OC)C1=C(OC)C=C2N(C)[C@@H]3[C@]4(CCN5CC=C[C@](CC)([C@@H]45)[C@@H](OC(=O)CN(C)C)[C@]3(O)C(=O)OC)C2=C1

InChIKey

InChIKey=UNMODLJJNIJIBD-KLAPOHTHSA-N

Formula

C48H65N5O13S

Mass

952.13

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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 - Alpha-amino acid ester - Carbazole - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Indole or derivatives - Tricarboxylic acid or derivatives - Tertiary aliphatic/aromatic amine - Anisole - Dialkylarylamine - Alkyl aryl ether - Aralkylamine - Sulfuric acid - Piperidine - N-alkylpyrrolidine - Benzenoid - Cyclic alcohol - Heteroaromatic compound - Organic sulfuric acid or derivatives - Methyl ester - Pyrrole - Pyrrolidine - Tertiary alcohol - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - 1,2-aminoalcohol - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Ether - Carboxylic acid derivative - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Amine - Alcohol - Organic nitrogen 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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