Compound Identification
SMILES
COC(=O)[C@]1(O)C[C@H](O[C@H]2CC(NC(C)=O)[C@H](O)[C@H](C)O2)C2=C(O)C3=C(C(O)=C2C1)C(=O)C1=C(C(OC)=CC=C1)C3=O
InChIKey
InChIKey=QXCNPFYKPWAENQ-BYPDVNCASA-N
Formula
C29H31NO12
Mass
585.562
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 Anthracenecarboxylic acids Anthraquinones Naphthalenecarboxylic acids Hexoses O-glycosyl compounds Tetralins Anisoles Aryl ketones Alkyl aryl ethers Oxanes Acetamides Vinylogous acids Tertiary alcohols Methyl esters Secondary alcohols Secondary carboxylic acid amides Polyols Oxacyclic compounds Monocarboxylic acids and derivatives Acetals Hydrocarbon derivatives Aldehydes Organonitrogen compounds Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Anthracycline - Anthracyclinone-skeleton - Tetracenequinone - Anthracene carboxylic acid - Anthracene carboxylic acid or derivatives - 9,10-anthraquinone - 1,4-anthraquinone - Anthracene - 2-naphthalenecarboxylic acid - 2-naphthalenecarboxylic acid or derivatives - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Tetralin - Anisole - Aryl ketone - Alkyl aryl ether - Benzenoid - Oxane - Monosaccharide - Methyl ester - Acetamide - Tertiary alcohol - Vinylogous acid - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Secondary alcohol - Ketone - Ether - Organoheterocyclic compound - Oxacycle - Polyol - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Acetal - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alcohol - Aldehyde - 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