Compound Identification
SMILES
C[C@]1(OC(=O)CC(=O)OCC=C)[C@@H](CC2SCCCS2)CC(=O)C2=C1C=CC=C2O
InChIKey
InChIKey=MVVCYLGCCZQQCN-PEBXRYMYSA-N
Formula
C22H26O6S2
Mass
450.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Tetralins
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Tetralins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetralins
Alternative Parents
Aryl alkyl ketones 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Dithianes Dicarboxylic acids and derivatives 1,3-dicarbonyl compounds Vinylogous acids Dithioacetals Carboxylic acid esters Dialkylthioethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tetralin - Aryl ketone - Aryl alkyl ketone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Dicarboxylic acid or derivatives - 1,3-dithiane - 1,3-dicarbonyl compound - Thioacetal - Vinylogous acid - Ketone - Carboxylic acid ester - Thioether - Organoheterocyclic compound - Carboxylic acid derivative - Dialkylthioether - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.
External Descriptors
Not available