Compound Identification
SMILES
COC1=CC(O)=C2C(=O)C3=CC4=C(C(O)=C3C(=O)C2=C1)C1=C(O)C(C(=O)NCC(O)=O)=C(C)C=C1[C@H](O[C@@H]1O[C@H](C)[C@H](N)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O)[C@H]4O
InChIKey
InChIKey=HELMFNXPQUQJFY-FPDYCEOPSA-N
Formula
C38H40N2O18
Mass
812.734
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 Naphthalenecarboxamides N-acyl-alpha amino acids O-glycosyl compounds Naphthols and derivatives Disaccharides Salicylic acid and derivatives Aryl ketones Anisoles 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Oxanes Vinylogous acids Amino acids Secondary carboxylic acid amides Secondary alcohols Polyols Oxacyclic compounds Acetals Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Aldehydes Monoalkylamines Hydrocarbon derivatives Organopnictogen compounds
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 - Disaccharide - Glycosyl compound - 1-naphthol - O-glycosyl compound - Salicylic acid or derivatives - Alpha-amino acid or derivatives - Aryl ketone - Anisole - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Amino saccharide - Oxane - Vinylogous acid - Secondary alcohol - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Amino acid - Ketone - Polyol - Acetal - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aldehyde - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Amine - Primary amine - Hydrocarbon derivative - Alcohol - Primary aliphatic amine - 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