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Structure Information
Structure

Compound Identification

SMILES

Cl.COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3CC(O)(CC(OC4CC(N)C(O)C(C)O4)C3=C1O)C(\C)=N\NC(=O)C1=CC=C(C=C1)C1=CC=CC=C1)C2=O

InChIKey

InChIKey=HXGOMIWIDNPPPN-LCZJMEFLSA-N

Formula

C40H40ClN3O10

Mass

758.22

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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 - 9,10-anthraquinone - 1,4-anthraquinone - Anthracene - Biphenyl - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Tetralin - Benzoic acid or derivatives - Anisole - Benzoyl - Aryl ketone - Alkyl aryl ether - Amino saccharide - Oxane - Monocyclic benzene moiety - Benzenoid - Monosaccharide - Vinylogous acid - Tertiary alcohol - Ketone - Secondary alcohol - 1,2-aminoalcohol - Amino acid or derivatives - Polyol - Acetal - Ether - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Hydrochloride - Aldehyde - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Alcohol - Organooxygen compound - Primary aliphatic amine - Primary amine - Organonitrogen compound - Amine - 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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