Compound Identification
SMILES
CCCCCC(O)(C(=O)O[C@H]1C[N+]2(CCCOC3=CC=CC=C3)CCC1CC2)C1=CC=CS1
InChIKey
InChIKey=MVZFLVIPKLXNJL-AMWOMDESSA-N
Formula
C27H38NO4S
Mass
472.66
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 Alkyl aryl ethers Fatty acid esters Piperidines Thiophenes Tetraalkylammonium salts Tertiary alcohols Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Aromatic alcohols Amines Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxy compound - Phenol ether - Quinuclidine - Alkyl aryl ether - Fatty acid ester - Monocyclic benzene moiety - Piperidine - Benzenoid - Fatty acyl - Tetraalkylammonium salt - Quaternary ammonium salt - Heteroaromatic compound - Tertiary alcohol - Thiophene - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Amine - Aromatic alcohol - Organonitrogen compound - Organooxygen compound - Organic oxide - Alcohol - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - 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