Compound Identification
SMILES
COC(=O)C1=CC=C(C=C1)C1NC(CCSC)(C2C1C(=O)N(CC1=CC3=C(C=C1)C(=O)C1=CC=CC=C1C3=O)C2=O)C(O)=O
InChIKey
InChIKey=WMSIUDNUGKYXJC-UHFFFAOYSA-N
Formula
C33H28N2O8S
Mass
612.65
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
Phenylpyrrolidines Alpha amino acids Benzoic acid esters Pyrrolidine carboxylic acids Aryl ketones Benzoyl derivatives Aralkylamines Pyrrolidine-2-ones N-substituted carboxylic acid imides N-alkylpyrrolidines Dicarboximides Pyrroles Methyl esters Lactams Amino acids Dialkylthioethers Dialkylamines Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Sulfenyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
9,10-anthraquinone - Anthraquinone - 2-phenylpyrrolidine - Alpha-amino acid - Alpha-amino acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Aryl ketone - Aralkylamine - N-alkylpyrrolidine - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - 2-pyrrolidone - Pyrrolidone - Methyl ester - Carboxylic acid imide - Dicarboximide - Pyrrole - Pyrrolidine - Amino acid - Lactam - Ketone - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Thioether - Sulfenyl compound - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Carboxylic acid - Secondary amine - Organoheterocyclic compound - Carboxylic acid derivative - Dialkylthioether - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - 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