Structure Information
Structure

Compound Identification

SMILES

OC1=CC(OCCC[N+]23CCC(CC2)[C@H](C3)NC(=O)C(O)(C2=CC=CS2)C2=CC=CS2)=CC=C1

InChIKey

InChIKey=HHISPEALAWWROF-JKLGZZSBSA-O

Formula

C26H31N2O4S2

Mass

499.66

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Quinuclidines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Quinuclidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenoxy compound - Quinuclidine - Phenol ether - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Piperidine - Benzenoid - Tertiary alcohol - Thiophene - Heteroaromatic compound - Tetraalkylammonium salt - Quaternary ammonium salt - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Ether - Azacycle - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Alcohol - Organic oxide - Carbonyl group - Organic oxygen compound - Amine - Aromatic alcohol - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as quinuclidines. These are compounds containing a 1-azabicyclo[2.2.2]octane moiety.

External Descriptors

Not available

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