Compound Identification
SMILES
CCOC(=O)C(CC=C(C)C)(\C=C\[S@@](=O)C1=CC=C(C)C=C1)C(=O)OCC
InChIKey
InChIKey=YDQGNDZAUXTOLH-BTUVCSFDSA-N
Formula
C21H28O5S
Mass
392.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenyl sulfoxides
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenyl sulfoxides
Intermediate Tree Nodes
Not available
Direct Parent
Phenyl sulfoxides
Alternative Parents
Toluenes Fatty acid esters Dicarboxylic acids and derivatives Sulfoxides Carboxylic acid esters Sulfinyl compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenyl sulfoxide - Fatty acid ester - Toluene - Dicarboxylic acid or derivatives - Fatty acyl - Carboxylic acid ester - Sulfoxide - Carboxylic acid derivative - Sulfinyl compound - Carbonyl group - Organosulfur compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl sulfoxides. These are organosulfur compounds containing a sulfoxide group substituted with a phenyl group.
External Descriptors
Not available