Compound Identification
SMILES
CN[C@H]1[C@@H](C)O[C@@H](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)NCCN)=C(C)C=C23)[C@H](O)[C@H]1O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O
InChIKey
InChIKey=XNXUJRWFYRYOFM-CLTGSWEDSA-N
Formula
C39H45N3O16
Mass
811.794
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 Disaccharides 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 and derivatives Polyols Oxacyclic compounds Acetals Dialkylamines Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aminoglycoside core - Tetracenequinone - 9,10-anthraquinone - 1,4-anthraquinone - Anthracene - Phenanthrene - 2-naphthalenecarboxamide - 2-naphthalenecarboxylic acid or derivatives - Disaccharide - Glycosyl compound - 1-naphthol - O-glycosyl compound - Salicylic acid or derivatives - Anisole - Aryl ketone - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Alkyl aryl ether - Amino saccharide - Oxane - Vinylogous acid - Carboxamide group - Ketone - Secondary carboxylic acid amide - Amino acid or derivatives - Secondary alcohol - Acetal - Oxacycle - Secondary aliphatic amine - Secondary amine - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Polyol - Primary amine - Alcohol - Organic oxygen compound - Primary aliphatic amine - Organopnictogen compound - Organic oxide - Organic nitrogen compound - Aldehyde - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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