Compound Identification
SMILES
COS([O-])(=O)=O.CC(CNC1=C2C(=O)C3=CC=CC=C3C(=O)C2=C(O)C=C1)[NH+]1CCOCC1
InChIKey
InChIKey=LEZVVICGRARMGL-UHFFFAOYSA-N
Formula
C22H26N2O8S
Mass
478.52
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
Aryl ketones Secondary alkylarylamines 1-hydroxy-2-unsubstituted benzenoids Sulfuric acid monoesters Alkyl sulfates Morpholines Vinylogous amides Vinylogous acids Quaternary ammonium salts Trialkylamines Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
9,10-anthraquinone - Anthraquinone - Aryl ketone - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Secondary aliphatic/aromatic amine - Morpholine - Oxazinane - Sulfuric acid monoester - Sulfate-ester - Alkyl sulfate - Sulfuric acid ester - Organic sulfuric acid or derivatives - Quaternary ammonium salt - Vinylogous amide - Vinylogous acid - Tertiary aliphatic amine - Ketone - Organoheterocyclic compound - Dialkyl ether - Ether - Secondary amine - Oxacycle - Azacycle - Amine - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - 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