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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Quinuclidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinuclidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Quinuclidines
Alternative Parents
Phenoxy compounds Phenol ethers 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Piperidines Thiophenes Tetraalkylammonium salts Tertiary alcohols Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Organic oxides Carbonyl compounds Aromatic alcohols Amines Hydrocarbon derivatives Organic cations
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