Compound Identification
SMILES
CCOC(=O)C1CC2=CC3=CC4=C(C=C3C=C2CN1S(=O)(=O)C1=CC=C(C)C=C1)C(=O)C1=CC2=CC=CC=C2C=C1C4=O
InChIKey
InChIKey=BCJLYLGFGHHPHW-UHFFFAOYSA-N
Formula
C35H27NO6S
Mass
589.66
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Pentacenequinones
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Pentacenequinones
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pentacenequinones
Alternative Parents
Naphthacenes Anthraquinones Alpha amino acid esters N,N-disubstituted p-toluenesulfonamides Tetrahydroisoquinolines Benzenesulfonamides Benzenesulfonyl compounds Aryl ketones Organosulfonamides Sulfonyls Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pentacenequinone - Tetracene - 9,10-anthraquinone - 1,4-anthraquinone - Alpha-amino acid ester - N,n-disubstituted p-toluenesulfonamide - P-toluenesulfonamide - Alpha-amino acid or derivatives - Benzenesulfonamide - Tetrahydroisoquinoline - Tosyl compound - Benzenesulfonyl group - Aryl ketone - Toluene - Organosulfonic acid amide - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxylic acid ester - Ketone - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pentacenequinones. These are compounds containing a pentacenequinone moiety, which consists of five linearly fused benzene ring, with at least one bearing two ketones.
External Descriptors
Not available