Compound Identification
SMILES
CNC1C(C)OC(O[C@@H]2[C@@H](O)C3=C(C(O)=C4C(=O)C5=CC(OC)=CC(O)=C5C(=O)C4=C3)C3=C(O)C(C(=O)NC(C)C(=O)OC)=C(C)C=C23)C(O)C1OC1OC(CO)C(O)C1O
InChIKey
InChIKey=OTHZWTOIBWVEMI-IIOFOUJLSA-N
Formula
C41H46N2O18
Mass
854.815
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthacenes
- Subclass Tetracenequinones
-
Class
Naphthacenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthacenes
Subclass
Tetracenequinones
Intermediate Tree Nodes
Not available
Direct Parent
Tetracenequinones
Alternative Parents
Aminoglycosides Anthraquinones Phenanthrenes and derivatives Alpha amino acid esters N-acyl-alpha amino acids and derivatives Naphthalenecarboxamides Alanine and derivatives Disaccharides Naphthols and derivatives O-glycosyl compounds Salicylic acid and derivatives Anisoles Aryl ketones Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Oxanes Methyl esters Tetrahydrofurans Vinylogous acids Secondary alcohols Secondary carboxylic acid amides Monocarboxylic acids and derivatives Dialkylamines Acetals Polyols Oxacyclic compounds Hydrocarbon derivatives Primary alcohols Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aminoglycoside core - Tetracenequinone - 9,10-anthraquinone - 1,4-anthraquinone - Phenanthrene - Anthracene - Alpha-amino acid ester - 2-naphthalenecarboxylic acid or derivatives - 2-naphthalenecarboxamide - N-acyl-alpha amino acid or derivatives - O-glycosyl compound - 1-naphthol - Alanine or derivatives - Disaccharide - Glycosyl compound - Salicylic acid or derivatives - Alpha-amino acid or derivatives - Anisole - Aryl ketone - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Amino saccharide - Oxane - Tetrahydrofuran - Methyl ester - Vinylogous acid - Secondary alcohol - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Ketone - Polyol - Secondary amine - Acetal - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Oxacycle - Ether - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Primary alcohol - Alcohol - Amine - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetracenequinones. These are polyaromatic hydrocarbon derivatives containing a tetracyclic cycle made up of four linearly fused benzene rings, one of which bears two ketone groups at position 1 and 4.
External Descriptors
Not available