Compound Identification
SMILES
O=C1C2=CC3=C(C=CC(C4=CC=CC=C4)=C3C=C2C(=O)C2=CC3=C(C=CC(C4=CC=CC=C4)=C3C=C12)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=NIAGWHLAWZCCHT-UHFFFAOYSA-N
Formula
C46H28O2
Mass
612.728
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 Aryl ketones Benzene and substituted derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Pentacenequinone - Tetracene - 1,4-anthraquinone - 9,10-anthraquinone - Aryl ketone - Monocyclic benzene moiety - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic 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