Compound Identification
SMILES
COc1cc(O)c2C(=O)c3cc4[C@@H](O)[C@H](O[C@H]5O[C@@H](C)[C@@H](N)[C@@H](O[C@H]6OC[C@H](O)[C@@H](O)[C@@H]6O)[C@@H]5O)c5cc(C)c(C(=O)NC(C)C(O)=O)c(O)c5-c4c(O)c3C(=O)c2c1
InChIKey
InChIKey=IHIIRQILYAXIOH-NGBFZRTLSA-N
Formula
C39H42N2O18
Mass
826.761
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthacenes
- Subclass Tetracenequinones
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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 N-acyl-alpha amino acids Naphthalenecarboxamides Disaccharides Alanine and derivatives Naphthols and derivatives O-glycosyl compounds Salicylic acid and derivatives Aryl ketones Anisoles 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Oxanes Vinylogous acids Secondary carboxylic acid amides Secondary alcohols Amino acids Polyols Oxacyclic compounds Acetals Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives Aldehydes Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tetracenequinone - Aminoglycoside core - 1,4-anthraquinone - 9,10-anthraquinone - Phenanthrene - Anthracene - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - 2-naphthalenecarboxamide - 2-naphthalenecarboxylic acid or derivatives - Alanine or derivatives - Disaccharide - Glycosyl compound - 1-naphthol - O-glycosyl compound - Salicylic acid or derivatives - Alpha-amino acid or derivatives - Anisole - Aryl ketone - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Amino saccharide - Oxane - Vinylogous acid - Secondary alcohol - Carboxamide group - Amino acid - Amino acid or derivatives - Secondary carboxylic acid amide - Ketone - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Ether - Oxacycle - Acetal - Polyol - Organoheterocyclic compound - Organic nitrogen compound - Alcohol - Primary aliphatic amine - Carbonyl group - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Amine - Organopnictogen compound - Organic oxygen compound - Aldehyde - Organic anion - 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