Structure Information
Structure

Compound Identification

SMILES

COC1C(C)OC(OC2CC(C)(O)CC3=C2C(O)=C2C(=O)C4=C(O)C=C5C(OC6OC5(C)C(OC(C)=O)C(C6OC(C)=O)N(C)C)=C4C(=O)C2=C3)C(OC)C1(C)OC

InChIKey

InChIKey=NIWQUEFNNOIENB-UHFFFAOYSA-N

Formula

C41H51NO16

Mass

813.85

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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 - Aminoglycoside core - Tetracenequinone - 1,4-anthraquinone - 9,10-anthraquinone - Anthracene - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Tetralin - Aryl ketone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Amino saccharide - Benzenoid - Dicarboxylic acid or derivatives - Monosaccharide - Oxane - Vinylogous acid - Tertiary alcohol - Carboxylic acid ester - Amino acid or derivatives - Tertiary aliphatic amine - Ketone - Tertiary amine - Oxacycle - Carboxylic acid derivative - Acetal - Ether - Dialkyl ether - Polyol - Organoheterocyclic compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Amine - Alcohol - 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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