Structure Information
Structure

Compound Identification

SMILES

COC1C(OC2C(OC)C(C)(O)CC3=C2C(O)=C2C(=O)C4=C(C=CC5=C4OC4OC5(C)C(OC5CC(C)(C(OC6OC(C)C(O)C(C)(O)C6OC)C(C)O5)[N+]([O-])=O)C(C4O)N(C)C)C(=O)C2=C3)OC(C)C(O)C1(C)O

InChIKey

InChIKey=QYNAQIXCSIMIOO-UHFFFAOYSA-N

Formula

C51H70N2O22

Mass

1063.113

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Anthracyclines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Anthracyclines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Anthracycline - Anthracyclinone-skeleton - Oligosaccharide - Tetracenequinone - Aminoglycoside core - 9,10-anthraquinone - 1,4-anthraquinone - Anthracene - O-glycosyl compound - Glycosyl compound - Tetralin - Aryl ketone - Amino saccharide - 1-hydroxy-4-unsubstituted benzenoid - Aralkylamine - Benzenoid - Oxane - Vinylogous acid - Tertiary alcohol - 1,2-aminoalcohol - Ketone - C-nitro compound - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Organic nitro compound - Acetal - Oxacycle - Organoheterocyclic compound - Dialkyl ether - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Polyol - Organic oxoazanium - Amine - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Organic nitrogen compound - Alcohol - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as anthracyclines. These are polyketides containing a tetracenequinone ring structure with a sugar attached by glycosidic linkage.

External Descriptors

Not available

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