Structure Information
Structure

Compound Identification

SMILES

CCC(C)C(N)C(=O)NC1CC(O[C@H]2C[C@@](O)(CC3=C(O)C4=C(C(O)=C23)C(=O)C2=C(C=CC=C2OC)C4=O)C(C)=O)OC(C)C1O

InChIKey

InChIKey=UHQHWAJVNAHQLV-ORHOBWLSSA-N

Formula

C33H40N2O11

Mass

640.686

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