Compound Identification
SMILES
CC(C)(C1=CC=CC=C1)C1=CC(=C(OC2=C(N)C3=C(C(O)=C2)C(=O)[C@H]2C=CC=C[C@@H]2C3=O)C=C1)S(O)(=O)=O
InChIKey
InChIKey=HQJBABOQKZBNOU-OALUTQOASA-N
Formula
C29H25NO7S
Mass
531.58
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
Diphenylmethanes Diarylethers Tetralins Benzenesulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Phenylpropanes Benzenesulfonyl compounds Aryl alkyl ketones Quinones Phenoxy compounds Phenol ethers 1-hydroxy-2-unsubstituted benzenoids Vinylogous amides Vinylogous acids Sulfonyls Organosulfonic acids Primary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
9,10-anthraquinone - Anthraquinone - Diphenylmethane - Diaryl ether - Tetralin - Benzenesulfonate - 1-sulfo,2-unsubstituted aromatic compound - Phenylpropane - Benzenesulfonyl group - Arylsulfonic acid or derivatives - Phenoxy compound - Aryl alkyl ketone - Aryl ketone - Quinone - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Vinylogous amide - Vinylogous acid - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ketone - Ether - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organosulfur compound - Organic oxygen compound - Organic oxide - Primary amine - Hydrocarbon derivative - 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