Compound Identification
SMILES
COC1C(C)OC(OC2CC(C)(O)CC3=C(O)C4=C(C(O)=C23)C(=O)C2=C(C=CC(C)=C2OC)C4=O)C(O)C1OC
InChIKey
InChIKey=BOCNMPJNEZKZFJ-UHFFFAOYSA-N
Formula
C29H34O11
Mass
558.58
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 Hexoses O-glycosyl compounds Tetralins Anisoles Aryl ketones Alkyl aryl ethers Oxanes Vinylogous acids Tertiary alcohols Secondary alcohols Dialkyl ethers Oxacyclic compounds Polyols Acetals Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Anthracycline - Anthracyclinone-skeleton - Tetracenequinone - 9,10-anthraquinone - 1,4-anthraquinone - Anthracene - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Tetralin - Aryl ketone - Anisole - Alkyl aryl ether - Oxane - Benzenoid - Monosaccharide - Tertiary alcohol - Vinylogous acid - Secondary alcohol - Ketone - Ether - Dialkyl ether - Polyol - Organoheterocyclic compound - Acetal - Oxacycle - Organooxygen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - 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