Compound Identification
SMILES
COCCOC1=NC(Cl)=NC(NCC2=C(NC3=CC(=C(N)C4=C3C(=O)C3=CC=CC=C3C4=O)S(O)(=O)=O)C(=CC(C)=C2)S(O)(=O)=O)=N1
InChIKey
InChIKey=ADXCUSNLZAIHJJ-UHFFFAOYSA-N
Formula
C28H25ClN6O10S2
Mass
705.11
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
2-benzylamino-s-triazines Benzenesulfonic acids and derivatives Benzenesulfonyl compounds 1-sulfo,2-unsubstituted aromatic compounds Benzylamines Aryl ketones Aniline and substituted anilines Aminotoluenes Alkoxy-S-triazines Secondary alkylarylamines Chloro-s-triazines Alkyl aryl ethers Aryl chlorides Vinylogous amides Sulfonyls Organosulfonic acids Heteroaromatic compounds Dialkyl ethers Azacyclic compounds Primary amines Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Anthraquinone - 9,10-anthraquinone - 2-benzylamino-s-triazine - Benzenesulfonate - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - Alkoxy-s-triazine - Aminotoluene - Aniline or substituted anilines - Aryl ketone - Benzylamine - Chloro-s-triazine - Halo-s-triazine - N-aliphatic s-triazine - Toluene - Secondary aliphatic/aromatic amine - Aminotriazine - Amino-1,3,5-triazine - Alkyl aryl ether - 1,3,5-triazine - Triazine - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Heteroaromatic compound - Vinylogous amide - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ketone - Azacycle - Organoheterocyclic compound - Secondary amine - Ether - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Aromatic heteropolycyclic 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