Structure Information
Structure

Compound Identification

SMILES

COC1=CC2=C(C=CN=C2C=C1)[C@@H](O)[C@@H]1C[C@H]2CCN1C[C@@H]2C(C)Cl

InChIKey

InChIKey=TXQNNQYOMZKRKT-ACKFWONCSA-N

Formula

C20H25ClN2O2

Mass

360.88

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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

4-quinolinemethanols Quinuclidines Anisoles Alkyl aryl ethers Aralkylamines Pyridines and derivatives Piperidines Heteroaromatic compounds Trialkylamines 1,2-aminoalcohols Secondary alcohols Azacyclic compounds Aromatic alcohols Alkyl chlorides Hydrocarbon derivatives Organochlorides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cinchonan-skeleton - 4-quinolinemethanol - Quinoline - Anisole - Phenol ether - Quinuclidine - Alkyl aryl ether - Aralkylamine - Piperidine - Pyridine - Benzenoid - Heteroaromatic compound - Tertiary amine - Secondary alcohol - Tertiary aliphatic amine - 1,2-aminoalcohol - Organoheterocyclic compound - Azacycle - Ether - Organic nitrogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Alkyl halide - Alkyl chloride - Alcohol - Aromatic 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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