Compound Identification
SMILES
[Na+].COC1=C(C=C(NC2=CC(=C(N)C3=C2C(=O)C2=CC=CC=C2C3=O)S([O-])(=O)=O)C=C1)S(=O)(=O)CCO
InChIKey
InChIKey=QDOGHAUVEYBHJF-UHFFFAOYSA-M
Formula
C23H19N2NaO9S2
Mass
554.52
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
1-sulfo,2-unsubstituted aromatic compounds Aminophenyl ethers Benzenesulfonyl compounds Methoxyanilines Anisoles Aryl ketones Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Primary aromatic amines Sulfones Organosulfonic acids Vinylogous amides Secondary amines Organic oxides Hydrocarbon derivatives Organic sodium salts Primary alcohols Organic cations
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Anthraquinone - 9,10-anthraquinone - 1-sulfo,2-unsubstituted aromatic compound - Methoxyaniline - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Aminophenyl ether - Methoxybenzene - Aniline or substituted anilines - Phenol ether - Aryl ketone - Phenoxy compound - Anisole - Alkyl aryl ether - Monocyclic benzene moiety - Primary aromatic amine - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Vinylogous amide - Sulfone - Organosulfonic acid - Sulfonyl - Ketone - Secondary amine - Organic alkali metal salt - Ether - Organic nitrogen compound - Amine - Organic salt - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Alcohol - Primary alcohol - Organic sodium salt - Primary amine - Hydrocarbon derivative - Organic oxide - 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