Structure Information
Structure

Compound Identification

SMILES

CCCCCCC(C)(C(O)=O)S(=O)(=O)C1=CC=CC=C1.COC1=CC2=C(C=CN=C2C=C1)C(O)C1CC2CCN1CC2C=C

InChIKey

InChIKey=ZECYDVUQUCBMDL-UHFFFAOYSA-N

Formula

C35H46N2O6S

Mass

622.82

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Cinchona alkaloids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Cinchona alkaloids

Alternative Parents

Molecular Framework

Not available

Substituents

Cinchonan-skeleton - 4-quinolinemethanol - Quinoline - Benzenesulfonyl group - Medium-chain fatty acid - Quinuclidine - Anisole - Aralkylamine - Methyl-branched fatty acid - Thia fatty acid - Branched fatty acid - Alkyl aryl ether - Fatty acyl - Fatty acid - Benzenoid - Pyridine - Piperidine - Monocyclic benzene moiety - Heteroaromatic compound - Sulfonyl - Sulfone - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cinchona alkaloids. These are alkaloids structurally characterized by the presence of the cinchonan skeleton, which consists of a quinoline linked to an azabicyclo[2.2.2]octane moiety.

External Descriptors

Not available

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