Structure Information
Structure

Compound Identification

SMILES

CC[C@@]1(O)C[C@H](O[C@H]2C[C@@H]([C@H](O[C@H]3C[C@@H]4O[C@H]5CC(=O)[C@H](C)O[C@H]5O[C@@H]4[C@H](C)O3)[C@H](C)O2)N(C)C)C2=C(O)C3=C(C(O)=C2[C@H]1O[C@H]1C[C@@H]([C@H](O[C@H]2CCC(O[C@@H]4O[C@@H](C)C(=O)C=C4)[C@H](C)O2)[C@H](C)O1)N(C)C)C(=O)C1=C(C(O)=CC=C1)C3=O

InChIKey

InChIKey=SGOOJJACKKMDRV-NCSOINJOSA-N

Formula

C60H80N2O21

Mass

1165.293

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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 - O-glycosyl compound - Glycosyl compound - Disaccharide - Tetralin - Pyranodioxin - Aryl ketone - 1-hydroxy-4-unsubstituted benzenoid - Amino saccharide - Dihydropyranone - 1-hydroxy-2-unsubstituted benzenoid - Para-dioxane - Benzenoid - Oxane - Pyran - Tertiary alcohol - Vinylogous acid - Tertiary amine - Tertiary aliphatic amine - Cyclic ketone - Ketone - Polyol - Acetal - Ether - Organoheterocyclic compound - Dialkyl ether - Oxacycle - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organonitrogen compound - Aldehyde - 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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