Compound Identification
SMILES
COC1C(O)C(O)C(C)OC1O[C@H]1[C@H](OC)[C@@](C)(O)C(=O)C2=C1C(O)=C1C(=O)C3=C(C=CC=C3O)C(=O)C1=C2
InChIKey
InChIKey=PGCZNTNNZCKKFG-YZSUGWMWSA-N
Formula
C27H28O12
Mass
544.509
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Anthracyclines
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Anthracyclines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Anthracyclines
Alternative Parents
Tetracenequinones Anthraquinones Disaccharides O-glycosyl compounds Tetralins Aryl alkyl ketones 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Oxanes Acyloins Vinylogous acids Tertiary alcohols Secondary alcohols Polyols Oxacyclic compounds Dialkyl ethers Acetals Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Anthracycline - Anthracyclinone-skeleton - Tetracenequinone - 9,10-anthraquinone - 1,4-anthraquinone - Anthracene - Disaccharide - Glycosyl compound - O-glycosyl compound - Tetralin - Aryl alkyl ketone - Aryl ketone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Acyloin - Oxane - Tertiary alcohol - Vinylogous acid - Secondary alcohol - Ketone - Acetal - Polyol - Organoheterocyclic compound - Dialkyl ether - Oxacycle - Ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aldehyde - Organooxygen compound - 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