Compound Identification
SMILES
[Na+].CC1=C(NC2=C3C(=O)C4=CC=CC=C4C(=O)C3=C(O)C=C2)C=CC(=C1)S([O-])(=O)=O
InChIKey
InChIKey=FOANBYMIWSZSEX-UHFFFAOYSA-M
Formula
C21H14NNaO6S
Mass
431.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Anthracenes
- Subclass Anthraquinones
-
Class
Anthracenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Anthracenes
Subclass
Anthraquinones
Intermediate Tree Nodes
Not available
Direct Parent
Anthraquinones
Alternative Parents
Benzenesulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Aminotoluenes Aniline and substituted anilines Aryl ketones 1-hydroxy-2-unsubstituted benzenoids Primary aromatic amines Organosulfonic acids Vinylogous amides Sulfonyls Vinylogous acids Secondary amines Hydrocarbon derivatives Organic sodium salts Organic oxides Organic cations
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
9,10-anthraquinone - Anthraquinone - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Aryl ketone - Aminotoluene - Aniline or substituted anilines - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Toluene - Monocyclic benzene moiety - Primary aromatic amine - Vinylogous acid - Vinylogous amide - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ketone - Organic alkali metal salt - Secondary amine - Organic salt - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic sodium salt - Organic oxygen compound - Organic cation - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as anthraquinones. These are organic compounds containing either anthracene-9,10-quinone, 1,4-anthraquinone, or 1,2-anthraquinone.
External Descriptors
Not available