Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3C(CC(N)(CC3=C1O)C(C)O)[C@H]1C[C@H](N)[C@@H](O)[C@@H](C)O1)C2=O

InChIKey

InChIKey=XDYPERZCWQWJOX-VNWAHVRNSA-N

Formula

C27H32N2O8

Mass

512.559

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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 - Tetracenequinone - 9,10-anthraquinone - 1,4-anthraquinone - Anthracene - Tetralin - Anisole - Phenol ether - Aryl ketone - Aralkylamine - Alkyl aryl ether - Phenol - Benzenoid - Oxane - Vinylogous acid - Secondary alcohol - 1,2-aminoalcohol - Ketone - Organoheterocyclic compound - Ether - Dialkyl ether - Oxacycle - Organonitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Organooxygen compound - Primary 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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