Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3C[C@](O)(C[C@H](OC4CC(NC(=O)C(N)CCN)C(O)C(C)O4)C3=C1O)C(C)=O)C2=O

InChIKey

InChIKey=OXRRWZHNLXPQBD-JZKZOKNXSA-N

Formula

C31H37N3O11

Mass

627.647

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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 - Tetracenequinone - 1,4-anthraquinone - 9,10-anthraquinone - Anthracene - Hexose monosaccharide - Alpha-amino acid amide - Glycosyl compound - O-glycosyl compound - Alpha-amino acid or derivatives - Tetralin - Anisole - Aryl ketone - Alkyl aryl ether - N-acyl-amine - Monosaccharide - Fatty acyl - Fatty amide - Oxane - Benzenoid - Tertiary alcohol - Vinylogous acid - Alpha-hydroxy ketone - Amino acid or derivatives - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Ketone - Ether - Carboxylic acid derivative - Polyol - Oxacycle - Organoheterocyclic compound - Acetal - Primary aliphatic amine - Aldehyde - Organic oxygen compound - Organic nitrogen compound - Alcohol - Primary amine - Organopnictogen compound - Amine - Carbonyl group - Organic oxide - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - 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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